4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)-2-thienyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)-2-thiophenyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)thiophen-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[(3-carbethoxy-4-p-phenetyl-2-thienyl)amino]-4-keto-butyric acid Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)CCC(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)CCC(=O)O

InChI

InChI=1S/C19H21NO6S/c1-3-25-13-7-5-12(6-8-13)14-11-27-18(17(14)19(24)26-4-2)20-15(21)9-10-16(22)23/h5-8,11H,3-4,9-10H2,1-2H3,(H,20,21)(H,22,23)