1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]piperidine-2-carboxylic acid Openeye Name: 1-(6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperidine-2-carboxylic acid CAS Name: 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)piperidine-2-carboxylic acid Traditional Name: 1-(6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)pipecolinic acid Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)N3CCCCC3C(=O)O

Isomeric SMILES

CC1CCC2=C(C1)SC=C2C(=O)N3CCCCC3C(=O)O

InChI

InChI=1S/C16H21NO3S/c1-10-5-6-11-12(9-21-14(11)8-10)15(18)17-7-3-2-4-13(17)16(19)20/h9-10,13H,2-8H2,1H3,(H,19,20)