methyl 2-(4-chloranylbutanoylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(4-chloranylbutanoylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(4-chlorobutanoylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[(4-chloro-1-oxobutyl)amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-chlorobutanoylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(4-chlorobutanoylamino)-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C16H16ClNO3S MolecularWeight: 337.82114

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCCCl

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCCCl

InChI

InChI=1S/C16H16ClNO3S/c1-21-16(20)14-12(11-6-3-2-4-7-11)10-22-15(14)18-13(19)8-5-9-17/h2-4,6-7,10H,5,8-9H2,1H3,(H,18,19)