ethyl 3-[(4-acetamidophenyl)methylcarbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[(4-acetamidophenyl)methylcarbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[(4-acetamidophenyl)methylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[(4-acetamidophenyl)methylamino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-acetamidophenyl)methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[(4-acetamidobenzyl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C19H19N3O6 MolecularWeight: 385.37066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O6/c1-3-28-19(25)15-8-14(9-17(10-15)22(26)27)18(24)20-11-13-4-6-16(7-5-13)21-12(2)23/h4-10H,3,11H2,1-2H3,(H,20,24)(H,21,23)