butyl 4-[2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[(4-methoxy-3-nitro-benzoyl)amino]acetyl]amino]benzoate CAS Name: 4-[[2-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(4-methoxy-3-nitrobenzoyl)amino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(4-methoxy-3-nitro-benzoyl)amino]acetyl]amino]benzoic acid butyl ester Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O7/c1-3-4-11-31-21(27)14-5-8-16(9-6-14)23-19(25)13-22-20(26)15-7-10-18(30-2)17(12-15)24(28)29/h5-10,12H,3-4,11,13H2,1-2H3,(H,22,26)(H,23,25)