ethyl 4-[(3-nitrophenyl)carbonyl-(pyridin-4-ylmethyl)amino]benzoate

Systemtic Name: ethyl 4-[(3-nitrophenyl)carbonyl-(pyridin-4-ylmethyl)amino]benzoate Openeye Name: ethyl 4-[(3-nitrobenzoyl)-(4-pyridylmethyl)amino]benzoate CAS Name: 4-[[(3-nitrophenyl)-oxomethyl]-(pyridin-4-ylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-nitrobenzoyl)-(pyridin-4-ylmethyl)amino]benzoate Traditional Name: 4-[(3-nitrobenzoyl)-(4-pyridylmethyl)amino]benzoic acid ethyl ester Formula: C22H19N3O5 MolecularWeight: 405.40336

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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(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3O5/c1-2-30-22(27)17-6-8-19(9-7-17)24(15-16-10-12-23-13-11-16)21(26)18-4-3-5-20(14-18)25(28)29/h3-14H,2,15H2,1H3