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

Systemtic Name: 1-azanyl-4-[(4-methylphenyl)amino]-2-[(phenylmethyl)amino]anthracene-9,10-dione Openeye Name: 1-amino-2-(benzylamino)-4-(4-methylanilino)anthracene-9,10-dione CAS Name: 1-amino-4-(4-methylanilino)-2-[(phenylmethyl)amino]anthracene-9,10-dione IUPAC Name: 1-amino-2-(benzylamino)-4-(4-methylanilino)anthracene-9,10-dione Traditional Name: 1-amino-2-(benzylamino)-4-(p-toluidino)-9,10-anthraquinone Formula: C28H23N3O2 MolecularWeight: 433.50112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)NCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)NCC5=CC=CC=C5

InChI

InChI=1S/C28H23N3O2/c1-17-11-13-19(14-12-17)31-22-15-23(30-16-18-7-3-2-4-8-18)26(29)25-24(22)27(32)20-9-5-6-10-21(20)28(25)33/h2-15,30-31H,16,29H2,1H3