methyl 4-[[2-[(4-acetamidophenyl)sulfonylamino]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(4-acetamidophenyl)sulfonylamino]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[(4-acetamidophenyl)sulfonylamino]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]methyl]benzoic acid methyl ester Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H21N3O6S/c1-13(23)22-16-7-9-17(10-8-16)29(26,27)21-12-18(24)20-11-14-3-5-15(6-4-14)19(25)28-2/h3-10,21H,11-12H2,1-2H3,(H,20,24)(H,22,23)