1-[(4-methylphenyl)amino]-2-nitro-anthracene-9,10-dione

Systemtic Name: 1-[(4-methylphenyl)amino]-2-nitro-anthracene-9,10-dione Openeye Name: 1-(4-methylanilino)-2-nitro-anthracene-9,10-dione CAS Name: 1-(4-methylanilino)-2-nitroanthracene-9,10-dione IUPAC Name: 1-(4-methylanilino)-2-nitroanthracene-9,10-dione Traditional Name: 2-nitro-1-(p-toluidino)-9,10-anthraquinone Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

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