[2-(butylamino)-2-oxidanylidene-ethyl] 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 6-methyl-2,3-dihydrobenzothiophene-2-carboxylate CAS Name: 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate Traditional Name: 6-methyl-2,3-dihydrobenzothiophene-2-carboxylic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1CC2=C(S1)C=C(C=C2)C

Isomeric SMILES

CCCCNC(=O)COC(=O)C1CC2=C(S1)C=C(C=C2)C

InChI

InChI=1S/C16H21NO3S/c1-3-4-7-17-15(18)10-20-16(19)14-9-12-6-5-11(2)8-13(12)21-14/h5-6,8,14H,3-4,7,9-10H2,1-2H3,(H,17,18)