[2-(butylamino)-2-oxidanylidene-ethyl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate CAS Name: 4-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C21H26N2O5S/c1-4-5-12-22-20(24)14-28-21(25)17-8-10-18(11-9-17)23-29(26,27)19-13-15(2)6-7-16(19)3/h6-11,13,23H,4-5,12,14H2,1-3H3,(H,22,24)