1-[2-[3,3-bis(4-chlorophenyl)propoxy]ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[3,3-bis(4-chlorophenyl)propoxy]ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[3,3-bis(4-chlorophenyl)propoxy]ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[3,3-bis(4-chlorophenyl)propoxy]ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[3,3-bis(4-chlorophenyl)propoxy]ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-[3,3-bis(4-chlorophenyl)propoxy]ethyl]nipecotic acid Formula: C23H27Cl2NO3 MolecularWeight: 436.37138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCOCCC(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCOCCC(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C23H27Cl2NO3/c24-20-7-3-17(4-8-20)22(18-5-9-21(25)10-6-18)11-14-29-15-13-26-12-1-2-19(16-26)23(27)28/h3-10,19,22H,1-2,11-16H2,(H,27,28)