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

Systemtic Name: methyl 1-[[(6R)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]carbonyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(6R)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[(6R)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(6R)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[(6R)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]isonipecotic acid methyl ester Formula: C17H23NO3S MolecularWeight: 321.43442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

C[C@@H]1CCC2=C(C1)SC=C2C(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C17H23NO3S/c1-11-3-4-13-14(10-22-15(13)9-11)16(19)18-7-5-12(6-8-18)17(20)21-2/h10-12H,3-9H2,1-2H3/t11-/m1/s1