(4-methylphenyl) 1-azanyl-4-naphthalen-2-ylsulfanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: (4-methylphenyl) 1-azanyl-4-naphthalen-2-ylsulfanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: p-tolyl 1-amino-4-(2-naphthylsulfanyl)-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-amino-4-(2-naphthalenylthio)-9,10-dioxo-2-anthracenecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 1-amino-4-naphthalen-2-ylsulfanyl-9,10-dioxoanthracene-2-carboxylate Traditional Name: 1-amino-9,10-diketo-4-(2-naphthylthio)anthracene-2-carboxylic acid p-tolyl ester Formula: C32H21NO4S MolecularWeight: 515.57844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C2=CC(=C3C(=C2N)C(=O)C4=CC=CC=C4C3=O)SC5=CC6=CC=CC=C6C=C5

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C2=CC(=C3C(=C2N)C(=O)C4=CC=CC=C4C3=O)SC5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C32H21NO4S/c1-18-10-13-21(14-11-18)37-32(36)25-17-26(38-22-15-12-19-6-2-3-7-20(19)16-22)27-28(29(25)33)31(35)24-9-5-4-8-23(24)30(27)34/h2-17H,33H2,1H3