ethyl 4-[(4-methoxy-3-nitro-phenyl)carbonyl-(pyridin-4-ylmethyl)amino]benzoate

Systemtic Name: ethyl 4-[(4-methoxy-3-nitro-phenyl)carbonyl-(pyridin-4-ylmethyl)amino]benzoate Openeye Name: ethyl 4-[(4-methoxy-3-nitro-benzoyl)-(4-pyridylmethyl)amino]benzoate CAS Name: 4-[[(4-methoxy-3-nitrophenyl)-oxomethyl]-(pyridin-4-ylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-methoxy-3-nitrobenzoyl)-(pyridin-4-ylmethyl)amino]benzoate Traditional Name: 4-[(4-methoxy-3-nitro-benzoyl)-(4-pyridylmethyl)amino]benzoic acid ethyl ester Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(CC2=CC=NC=C2)C(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CC2=CC=NC=C2)C(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O6/c1-3-32-23(28)17-4-7-19(8-5-17)25(15-16-10-12-24-13-11-16)22(27)18-6-9-21(31-2)20(14-18)26(29)30/h4-14H,3,15H2,1-2H3