(E)-4-[[2,5-diethoxy-4-(thiophen-2-ylcarbonylamino)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[2,5-diethoxy-4-(thiophen-2-ylcarbonylamino)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2,5-diethoxy-4-(thiophene-2-carbonylamino)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2,5-diethoxy-4-[[oxo(thiophen-2-yl)methyl]amino]anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2,5-diethoxy-4-(thiophene-2-carbonylamino)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[2,5-diethoxy-4-(2-thenoylamino)anilino]-4-keto-but-2-enoic acid Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OCC)NC(=O)C=CC(=O)O

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OCC)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C19H20N2O6S/c1-3-26-14-11-13(21-19(25)16-6-5-9-28-16)15(27-4-2)10-12(14)20-17(22)7-8-18(23)24/h5-11H,3-4H2,1-2H3,(H,20,22)(H,21,25)(H,23,24)/b8-7+