ethyl 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)isonipecotic acid ethyl ester Formula: C18H25NO3S MolecularWeight: 335.461

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CSC3=C2CCC(C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CSC3=C2CCC(C3)C

InChI

InChI=1S/C18H25NO3S/c1-3-22-18(21)13-6-8-19(9-7-13)17(20)15-11-23-16-10-12(2)4-5-14(15)16/h11-13H,3-10H2,1-2H3