(1R,2S)-2-[4-(phenylmethyl)piperidin-1-yl]carbonylcyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[4-(phenylmethyl)piperidin-1-yl]carbonylcyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-(4-benzylpiperidine-1-carbonyl)cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-(4-benzylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-(4-benzylpiperidine-1-carbonyl)cyclohexanecarboxylic acid Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC[C@H]([C@H](C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H27NO3/c22-19(17-8-4-5-9-18(17)20(23)24)21-12-10-16(11-13-21)14-15-6-2-1-3-7-15/h1-3,6-7,16-18H,4-5,8-14H2,(H,23,24)/t17-,18+/m0/s1