[5-methyl-2-[(4-nitrophenyl)carbonylamino]phenyl] 4-nitrobenzoate

Systemtic Name: [5-methyl-2-[(4-nitrophenyl)carbonylamino]phenyl] 4-nitrobenzoate Openeye Name: [5-methyl-2-[(4-nitrobenzoyl)amino]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [5-methyl-2-[[(4-nitrophenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [5-methyl-2-[(4-nitrobenzoyl)amino]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [5-methyl-2-[(4-nitrobenzoyl)amino]phenyl] ester Formula: C21H15N3O7 MolecularWeight: 421.3597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O7/c1-13-2-11-18(22-20(25)14-3-7-16(8-4-14)23(27)28)19(12-13)31-21(26)15-5-9-17(10-6-15)24(29)30/h2-12H,1H3,(H,22,25)