(2S)-5-(butylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-5-(butylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-(butylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxo-pentanoic acid CAS Name: (2S)-5-(butylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxopentanoic acid IUPAC Name: (2S)-5-(butylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxopentanoic acid Traditional Name: (2S)-5-(butylamino)-5-keto-2-[(4-methoxyphenyl)sulfonylamino]valeric acid Formula: C16H24N2O6S MolecularWeight: 372.43656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CCCCNC(=O)CC[C@@H](C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C16H24N2O6S/c1-3-4-11-17-15(19)10-9-14(16(20)21)18-25(22,23)13-7-5-12(24-2)6-8-13/h5-8,14,18H,3-4,9-11H2,1-2H3,(H,17,19)(H,20,21)/t14-/m0/s1