methyl 3-[(E)-5-(dimethylamino)-3-oxidanylidene-pent-4-en-2-yl]oxythiophene-2-carboxylate

Systemtic Name: methyl 3-[(E)-5-(dimethylamino)-3-oxidanylidene-pent-4-en-2-yl]oxythiophene-2-carboxylate Openeye Name: methyl 3-[(E)-4-(dimethylamino)-1-methyl-2-oxo-but-3-enoxy]thiophene-2-carboxylate CAS Name: 3-[(E)-5-(dimethylamino)-3-oxopent-4-en-2-yl]oxy-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-5-(dimethylamino)-3-oxopent-4-en-2-yl]oxythiophene-2-carboxylate Traditional Name: 3-[(E)-4-(dimethylamino)-2-keto-1-methyl-but-3-enoxy]thiophene-2-carboxylic acid methyl ester Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C=CN(C)C)OC1=C(SC=C1)C(=O)OC

Isomeric SMILES

CC(C(=O)/C=C/N(C)C)OC1=C(SC=C1)C(=O)OC

InChI

InChI=1S/C13H17NO4S/c1-9(10(15)5-7-14(2)3)18-11-6-8-19-12(11)13(16)17-4/h5-9H,1-4H3/b7-5+