6-(2-methyl-3-nitro-phenyl)benzo[d][2]benzazepine-5,7-dione

Systemtic Name: 6-(2-methyl-3-nitro-phenyl)benzo[d][2]benzazepine-5,7-dione Openeye Name: 6-(2-methyl-3-nitro-phenyl)benzo[d][2]benzazepine-5,7-dione CAS Name: 6-(2-methyl-3-nitrophenyl)benzo[d][2]benzazepine-5,7-dione IUPAC Name: 6-(2-methyl-3-nitrophenyl)benzo[d][2]benzazepine-5,7-dione Traditional Name: 6-(2-methyl-3-nitro-phenyl)benzo[d][2]benzazepine-5,7-quinone Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])N2C(=O)C3=CC=CC=C3C4=CC=CC=C4C2=O

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])N2C(=O)C3=CC=CC=C3C4=CC=CC=C4C2=O

InChI

InChI=1S/C21H14N2O4/c1-13-18(11-6-12-19(13)23(26)27)22-20(24)16-9-4-2-7-14(16)15-8-3-5-10-17(15)21(22)25/h2-12H,1H3