2-(2-cyanoethanoylamino)-4-(4-prop-2-enoxyphenyl)thiophene-3-carboxylic acid

Systemtic Name: 2-(2-cyanoethanoylamino)-4-(4-prop-2-enoxyphenyl)thiophene-3-carboxylic acid Openeye Name: 4-(4-allyloxyphenyl)-2-[(2-cyanoacetyl)amino]thiophene-3-carboxylic acid CAS Name: 2-[(2-cyano-1-oxoethyl)amino]-4-(4-prop-2-enoxyphenyl)-3-thiophenecarboxylic acid IUPAC Name: 2-[(2-cyanoacetyl)amino]-4-(4-prop-2-enoxyphenyl)thiophene-3-carboxylic acid Traditional Name: 4-(4-allyloxyphenyl)-2-[(2-cyanoacetyl)amino]-3-thenoic acid Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O4S/c1-2-9-23-12-5-3-11(4-6-12)13-10-24-16(15(13)17(21)22)19-14(20)7-8-18/h2-6,10H,1,7,9H2,(H,19,20)(H,21,22)