[2-(cycloheptylamino)-2-oxidanylidene-ethyl] 1-benzothiophene-2-carboxylate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 1-benzothiophene-2-carboxylate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] benzothiophene-2-carboxylate CAS Name: 1-benzothiophene-2-carboxylic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 1-benzothiophene-2-carboxylate Traditional Name: benzothiophene-2-carboxylic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)COC(=O)C2=CC3=CC=CC=C3S2

Isomeric SMILES

C1CCCC(CC1)NC(=O)COC(=O)C2=CC3=CC=CC=C3S2

InChI

InChI=1S/C18H21NO3S/c20-17(19-14-8-3-1-2-4-9-14)12-22-18(21)16-11-13-7-5-6-10-15(13)23-16/h5-7,10-11,14H,1-4,8-9,12H2,(H,19,20)