(E)-4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)thiophen-2-yl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)thiophen-2-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)-2-thienyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)-2-thiophenyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[3-ethoxycarbonyl-4-(4-ethoxyphenyl)thiophen-2-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(3-carbethoxy-4-p-phenetyl-2-thienyl)amino]-4-keto-but-2-enoic acid Formula: C19H19NO6S MolecularWeight: 389.42226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO6S/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/h5-11H,3-4H2,1-2H3,(H,20,21)(H,22,23)/b10-9+