1-[(5-chloranyl-2-ethoxy-phenyl)-phenyl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-ethoxy-phenyl)-phenyl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(5-chloro-2-ethoxy-phenyl)-phenyl-methyl]piperidine-3-carboxylic acid CAS Name: 1-[(5-chloro-2-ethoxyphenyl)-phenylmethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-ethoxyphenyl)-phenylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(5-chloro-2-ethoxy-phenyl)-phenyl-methyl]nipecotic acid Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C2=CC=CC=C2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(C2=CC=CC=C2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C21H24ClNO3/c1-2-26-19-11-10-17(22)13-18(19)20(15-7-4-3-5-8-15)23-12-6-9-16(14-23)21(24)25/h3-5,7-8,10-11,13,16,20H,2,6,9,12,14H2,1H3,(H,24,25)