5-naphthalen-1-yl-1-[(4-nitrophenyl)amino]-2-sulfanyl-anthracene-9,10-dione

Systemtic Name: 5-naphthalen-1-yl-1-[(4-nitrophenyl)amino]-2-sulfanyl-anthracene-9,10-dione Openeye Name: 5-(1-naphthyl)-1-(4-nitroanilino)-2-sulfanyl-anthracene-9,10-dione CAS Name: 2-mercapto-5-(1-naphthalenyl)-1-(4-nitroanilino)anthracene-9,10-dione IUPAC Name: 5-naphthalen-1-yl-1-(4-nitroanilino)-2-sulfanylanthracene-9,10-dione Traditional Name: 2-mercapto-5-(1-naphthyl)-1-(4-nitroanilino)-9,10-anthraquinone Formula: C30H18N2O4S MolecularWeight: 502.53992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=C4C(=CC=C3)C(=O)C5=C(C4=O)C=CC(=C5NC6=CC=C(C=C6)[N+](=O)[O-])S

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=C4C(=CC=C3)C(=O)C5=C(C4=O)C=CC(=C5NC6=CC=C(C=C6)[N+](=O)[O-])S

InChI

InChI=1S/C30H18N2O4S/c33-29-24-15-16-25(37)28(31-18-11-13-19(14-12-18)32(35)36)27(24)30(34)23-10-4-9-22(26(23)29)21-8-3-6-17-5-1-2-7-20(17)21/h1-16,31,37H