1-[2-[(E)-3-(3-methylphenyl)-3-phenyl-prop-2-enoxy]ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[(E)-3-(3-methylphenyl)-3-phenyl-prop-2-enoxy]ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[(E)-3-(m-tolyl)-3-phenyl-allyloxy]ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[(E)-3-(3-methylphenyl)-3-phenylprop-2-enoxy]ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[(E)-3-(3-methylphenyl)-3-phenylprop-2-enoxy]ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-[(E)-3-(m-tolyl)-3-phenyl-allyloxy]ethyl]nipecotic acid Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=CCOCCN2CCCC(C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)/C(=C/COCCN2CCCC(C2)C(=O)O)/C3=CC=CC=C3

InChI

InChI=1S/C24H29NO3/c1-19-7-5-10-21(17-19)23(20-8-3-2-4-9-20)12-15-28-16-14-25-13-6-11-22(18-25)24(26)27/h2-5,7-10,12,17,22H,6,11,13-16,18H2,1H3,(H,26,27)/b23-12+