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88758-51-4 | Ethanimidamide, N-[[(phenylmethoxy)carbonyl]oxy]-2-(8-quinolinyloxy)-
CAS No: 88758-51-4 Catalog No: AG008BLD MDL No:
Product Description
Catalog Number:
AG008BLD
Chemical Name:
Ethanimidamide, N-[[(phenylmethoxy)carbonyl]oxy]-2-(8-quinolinyloxy)-
CAS Number:
88758-51-4
Molecular Formula:
C19H17N3O4
Molecular Weight:
351.3560
IUPAC Name:
[(1-amino-2-quinolin-8-yloxyethylidene)amino] benzyl carbonate
InChI:
InChI=1S/C19H17N3O4/c20-17(22-26-19(23)25-12-14-6-2-1-3-7-14)13-24-16-10-4-8-15-9-5-11-21-18(15)16/h1-11H,12-13H2,(H2,20,22)
InChI Key:
XZICVNRWLHXTQA-UHFFFAOYSA-N
SMILES:
N=C(COc1cccc2c1nccc2)NOC(=O)OCc1ccccc1
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.122g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
351.362g/mol
Monoisotopic Mass:
351.122g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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