[2-nitro-4-[(3-nitrophenyl)iminomethyl]phenyl] 3-methylbenzoate

Systemtic Name: [2-nitro-4-[(3-nitrophenyl)iminomethyl]phenyl] 3-methylbenzoate Openeye Name: [2-nitro-4-[(3-nitrophenyl)iminomethyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-nitro-4-[(3-nitrophenyl)iminomethyl]phenyl] ester IUPAC Name: [2-nitro-4-[(3-nitrophenyl)iminomethyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-nitro-4-[(3-nitrophenyl)iminomethyl]phenyl] ester Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)C=NC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)C=NC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O6/c1-14-4-2-5-16(10-14)21(25)30-20-9-8-15(11-19(20)24(28)29)13-22-17-6-3-7-18(12-17)23(26)27/h2-13H,1H3