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

Systemtic Name: methyl 2-[2-[(4-acetamidophenyl)sulfonylamino]ethanoylamino]hexanoate Openeye Name: methyl 2-[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]hexanoate CAS Name: 2-[[2-[(4-acetamidophenyl)sulfonylamino]-1-oxoethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]hexanoate Traditional Name: 2-[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]hexanoic acid methyl ester Formula: C17H25N3O6S MolecularWeight: 399.4619

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)NC(=O)CNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C

Isomeric SMILES

CCCCC(C(=O)OC)NC(=O)CNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C

InChI

InChI=1S/C17H25N3O6S/c1-4-5-6-15(17(23)26-3)20-16(22)11-18-27(24,25)14-9-7-13(8-10-14)19-12(2)21/h7-10,15,18H,4-6,11H2,1-3H3,(H,19,21)(H,20,22)