(2R,3S)-2-[2-[(4-acetamidophenyl)sulfonylamino]ethanoylamino]-3-methyl-pentanoate

Systemtic Name: (2R,3S)-2-[2-[(4-acetamidophenyl)sulfonylamino]ethanoylamino]-3-methyl-pentanoate Openeye Name: (2R,3S)-2-[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[2-[(4-acetamidophenyl)sulfonylamino]-1-oxoethyl]amino]-3-methylpentanoate IUPAC Name: (2R,3S)-2-[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[2-[(4-acetamidophenyl)sulfonylamino]acetyl]amino]-3-methyl-valerate Formula: C16H22N3O6S- MolecularWeight: 384.42738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)[O-])NC(=O)CNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C

InChI

InChI=1S/C16H23N3O6S/c1-4-10(2)15(16(22)23)19-14(21)9-17-26(24,25)13-7-5-12(6-8-13)18-11(3)20/h5-8,10,15,17H,4,9H2,1-3H3,(H,18,20)(H,19,21)(H,22,23)/p-1/t10-,15+/m0/s1