(3R)-1-[(Z)-4-(4-methoxyphenyl)-4-phenyl-but-3-enyl]piperidine-3-carboxylic acid

Systemtic Name: (3R)-1-[(Z)-4-(4-methoxyphenyl)-4-phenyl-but-3-enyl]piperidine-3-carboxylic acid Openeye Name: (3R)-1-[(Z)-4-(4-methoxyphenyl)-4-phenyl-but-3-enyl]piperidine-3-carboxylic acid CAS Name: (3R)-1-[(Z)-4-(4-methoxyphenyl)-4-phenylbut-3-enyl]-3-piperidinecarboxylic acid IUPAC Name: (3R)-1-[(Z)-4-(4-methoxyphenyl)-4-phenylbut-3-enyl]piperidine-3-carboxylic acid Traditional Name: (3R)-1-[(Z)-4-(4-methoxyphenyl)-4-phenyl-but-3-enyl]nipecotic acid Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=CCCN2CCCC(C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C\CCN2CCC[C@H](C2)C(=O)O)/C3=CC=CC=C3

InChI

InChI=1S/C23H27NO3/c1-27-21-13-11-19(12-14-21)22(18-7-3-2-4-8-18)10-6-16-24-15-5-9-20(17-24)23(25)26/h2-4,7-8,10-14,20H,5-6,9,15-17H2,1H3,(H,25,26)/b22-10-/t20-/m1/s1