[3-[(2-methylphenyl)carbamoyl]naphthalen-2-yl] 3-aminocarbonyl-4-methyl-benzenesulfonate

Systemtic Name: [3-[(2-methylphenyl)carbamoyl]naphthalen-2-yl] 3-aminocarbonyl-4-methyl-benzenesulfonate Openeye Name: [3-(o-tolylcarbamoyl)-2-naphthyl] 3-carbamoyl-4-methyl-benzenesulfonate CAS Name: 3-carbamoyl-4-methylbenzenesulfonic acid [3-[(2-methylanilino)-oxomethyl]-2-naphthalenyl] ester IUPAC Name: [3-[(2-methylphenyl)carbamoyl]naphthalen-2-yl] 3-carbamoyl-4-methylbenzenesulfonate Traditional Name: 3-carbamoyl-4-methyl-benzenesulfonic acid [3-(o-tolylcarbamoyl)-2-naphthyl] ester Formula: C26H22N2O5S MolecularWeight: 474.52828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC3=CC=CC=C3C=C2C(=O)NC4=CC=CC=C4C)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC3=CC=CC=C3C=C2C(=O)NC4=CC=CC=C4C)C(=O)N

InChI

InChI=1S/C26H22N2O5S/c1-16-11-12-20(15-21(16)25(27)29)34(31,32)33-24-14-19-9-5-4-8-18(19)13-22(24)26(30)28-23-10-6-3-7-17(23)2/h3-15H,1-2H3,(H2,27,29)(H,28,30)