(2S)-2-cyclohexa-1,4-dien-1-yl-2-[(4-methylphenyl)sulfonylamino]ethanoic acid

Systemtic Name: (2S)-2-cyclohexa-1,4-dien-1-yl-2-[(4-methylphenyl)sulfonylamino]ethanoic acid Openeye Name: (2S)-2-cyclohexa-1,4-dien-1-yl-2-(p-tolylsulfonylamino)acetic acid CAS Name: (2S)-2-(1-cyclohexa-1,4-dienyl)-2-[(4-methylphenyl)sulfonylamino]acetic acid IUPAC Name: (2S)-2-cyclohexa-1,4-dien-1-yl-2-[(4-methylphenyl)sulfonylamino]acetic acid Traditional Name: (2S)-2-cyclohexa-1,4-dien-1-yl-2-(tosylamino)acetic acid Formula: C15H17NO4S MolecularWeight: 307.36478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CCC=CC2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C2=CCC=CC2)C(=O)O

InChI

InChI=1S/C15H17NO4S/c1-11-7-9-13(10-8-11)21(19,20)16-14(15(17)18)12-5-3-2-4-6-12/h2-3,6-10,14,16H,4-5H2,1H3,(H,17,18)/t14-/m0/s1