[3-[(2-methylphenyl)carbamoyl]naphthalen-2-yl] 3-cyanobenzenesulfonate

Systemtic Name: [3-[(2-methylphenyl)carbamoyl]naphthalen-2-yl] 3-cyanobenzenesulfonate Openeye Name: [3-(o-tolylcarbamoyl)-2-naphthyl] 3-cyanobenzenesulfonate CAS Name: 3-cyanobenzenesulfonic acid [3-[(2-methylanilino)-oxomethyl]-2-naphthalenyl] ester IUPAC Name: [3-[(2-methylphenyl)carbamoyl]naphthalen-2-yl] 3-cyanobenzenesulfonate Traditional Name: 3-cyanobenzenesulfonic acid [3-(o-tolylcarbamoyl)-2-naphthyl] ester Formula: C25H18N2O4S MolecularWeight: 442.48642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2OS(=O)(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2OS(=O)(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H18N2O4S/c1-17-7-2-5-12-23(17)27-25(28)22-14-19-9-3-4-10-20(19)15-24(22)31-32(29,30)21-11-6-8-18(13-21)16-26/h2-15H,1H3,(H,27,28)