[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 3-[phenyl-(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 3-[phenyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 3-[benzyl(phenyl)sulfamoyl]benzoate CAS Name: 3-[phenyl-(phenylmethyl)sulfamoyl]benzoic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 3-[benzyl(phenyl)sulfamoyl]benzoate Traditional Name: 3-[benzyl(phenyl)sulfamoyl]benzoic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H30N2O5S/c1-3-11-21(2)28-26(30)20-34-27(31)23-14-10-17-25(18-23)35(32,33)29(24-15-8-5-9-16-24)19-22-12-6-4-7-13-22/h4-10,12-18,21H,3,11,19-20H2,1-2H3,(H,28,30)