2-[(5-ethoxycarbonylthiophen-2-yl)-(4-methylphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(5-ethoxycarbonylthiophen-2-yl)-(4-methylphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[(5-ethoxycarbonyl-2-thienyl)-(p-tolylsulfonyl)amino]acetic acid CAS Name: 2-[(5-ethoxycarbonyl-2-thiophenyl)-(4-methylphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[(5-ethoxycarbonylthiophen-2-yl)-(4-methylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[(5-carbethoxy-2-thienyl)-tosyl-amino]acetic acid Formula: C16H17NO6S2 MolecularWeight: 383.43928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(S1)N(CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(S1)N(CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H17NO6S2/c1-3-23-16(20)13-8-9-14(24-13)17(10-15(18)19)25(21,22)12-6-4-11(2)5-7-12/h4-9H,3,10H2,1-2H3,(H,18,19)