[2-[4-(acetamidomethyl)phenyl]-2-oxidanylidene-ethyl] 2,5-dimethylthiophene-3-carboxylate

Systemtic Name: [2-[4-(acetamidomethyl)phenyl]-2-oxidanylidene-ethyl] 2,5-dimethylthiophene-3-carboxylate Openeye Name: [2-[4-(acetamidomethyl)phenyl]-2-oxo-ethyl] 2,5-dimethylthiophene-3-carboxylate CAS Name: 2,5-dimethyl-3-thiophenecarboxylic acid [2-[4-(acetamidomethyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(acetamidomethyl)phenyl]-2-oxoethyl] 2,5-dimethylthiophene-3-carboxylate Traditional Name: 2,5-dimethylthiophene-3-carboxylic acid [2-[4-(acetamidomethyl)phenyl]-2-keto-ethyl] ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)OCC(=O)C2=CC=C(C=C2)CNC(=O)C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)OCC(=O)C2=CC=C(C=C2)CNC(=O)C

InChI

InChI=1S/C18H19NO4S/c1-11-8-16(12(2)24-11)18(22)23-10-17(21)15-6-4-14(5-7-15)9-19-13(3)20/h4-8H,9-10H2,1-3H3,(H,19,20)