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Home > Nitro Compounds > 876126-59-9
876126-59-9 | Benzamide, 3-methoxy-N-(1-methyl-4-piperidinyl)-4-nitro-
CAS No: 876126-59-9 Catalog No: AG004I2T MDL No:
Product Description
Catalog Number:
AG004I2T
Chemical Name:
Benzamide, 3-methoxy-N-(1-methyl-4-piperidinyl)-4-nitro-
CAS Number:
876126-59-9
Molecular Formula:
C14H19N3O4
Molecular Weight:
293.3184
IUPAC Name:
3-methoxy-N-(1-methylpiperidin-4-yl)-4-nitrobenzamide
InChI:
InChI=1S/C14H19N3O4/c1-16-7-5-11(6-8-16)15-14(18)10-3-4-12(17(19)20)13(9-10)21-2/h3-4,9,11H,5-8H2,1-2H3,(H,15,18)
InChI Key:
VMXVRIYTWVAOEC-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1[N+](=O)[O-])C(=O)NC1CCN(CC1)C
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.138g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.323g/mol
Monoisotopic Mass:
293.138g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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