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

Systemtic Name: (2S)-5-(ethylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-(ethylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxo-pentanoic acid CAS Name: (2S)-5-(ethylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxopentanoic acid IUPAC Name: (2S)-5-(ethylamino)-2-[(4-methoxyphenyl)sulfonylamino]-5-oxopentanoic acid Traditional Name: (2S)-5-(ethylamino)-5-keto-2-[(4-methoxyphenyl)sulfonylamino]valeric acid Formula: C14H20N2O6S MolecularWeight: 344.3834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O6S/c1-3-15-13(17)9-8-12(14(18)19)16-23(20,21)11-6-4-10(22-2)5-7-11/h4-7,12,16H,3,8-9H2,1-2H3,(H,15,17)(H,18,19)/t12-/m0/s1