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Home > Nitro Compounds > 19208-05-0
19208-05-0 | Benzamide, N-[4-hydroxy-3-[(2-methyl-1-piperidinyl)methyl]phenyl]-4-nitro-
CAS No: 19208-05-0 Catalog No: AG002FNF MDL No:
Product Description
Catalog Number:
AG002FNF
Chemical Name:
Benzamide, N-[4-hydroxy-3-[(2-methyl-1-piperidinyl)methyl]phenyl]-4-nitro-
CAS Number:
19208-05-0
Molecular Formula:
C20H23N3O4
Molecular Weight:
369.4143
IUPAC Name:
N-[4-hydroxy-3-[(2-methylpiperidin-1-yl)methyl]phenyl]-4-nitrobenzamide
InChI:
InChI=1S/C20H23N3O4/c1-14-4-2-3-11-22(14)13-16-12-17(7-10-19(16)24)21-20(25)15-5-8-18(9-6-15)23(26)27/h5-10,12,14,24H,2-4,11,13H2,1H3,(H,21,25)
InChI Key:
PYLZOCKUJLCKRH-UHFFFAOYSA-N
SMILES:
CC1CCCCN1Cc1cc(ccc1O)NC(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
516
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.169g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
369.421g/mol
Monoisotopic Mass:
369.169g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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