6-(2-methyl-4-nitro-phenyl)benzo[d][2]benzazepine-5,7-dione

Systemtic Name: 6-(2-methyl-4-nitro-phenyl)benzo[d][2]benzazepine-5,7-dione Openeye Name: 6-(2-methyl-4-nitro-phenyl)benzo[d][2]benzazepine-5,7-dione CAS Name: 6-(2-methyl-4-nitrophenyl)benzo[d][2]benzazepine-5,7-dione IUPAC Name: 6-(2-methyl-4-nitrophenyl)benzo[d][2]benzazepine-5,7-dione Traditional Name: 6-(2-methyl-4-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/c1-13-12-14(23(26)27)10-11-19(13)22-20(24)17-8-4-2-6-15(17)16-7-3-5-9-18(16)21(22)25/h2-12H,1H3