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1-[(2-chlorophenyl)-(2,3-dimethoxyphenyl)methyl]piperidine-3-carboxylic acid

1-[(2-chlorophenyl)-(2,3-dimethoxyphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name:1-[(2-chlorophenyl)-(2,3-dimethoxyphenyl)methyl]piperidine-3-carboxylic acid
Openeye Name:1-[(2-chlorophenyl)-(2,3-dimethoxyphenyl)methyl]piperidine-3-carboxylic acid
CAS Name:1-[(2-chlorophenyl)-(2,3-dimethoxyphenyl)methyl]-3-piperidinecarboxylic acid
IUPAC Name:1-[(2-chlorophenyl)-(2,3-dimethoxyphenyl)methyl]piperidine-3-carboxylic acid
Traditional Name:1-[(2-chlorophenyl)-(2,3-dimethoxyphenyl)methyl]nipecotic acid
Formula: C21H24ClNO4
MolecularWeight: 389.87256
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(C2=CC=CC=C2Cl)N3CCCC(C3)C(=O)O


Isomeric SMILES

COC1=CC=CC(=C1OC)C(C2=CC=CC=C2Cl)N3CCCC(C3)C(=O)O


InChI

InChI=1S/C21H24ClNO4/c1-26-18-11-5-9-16(20(18)27-2)19(15-8-3-4-10-17(15)22)23-12-6-7-14(13-23)21(24)25/h3-5,8-11,14,19H,6-7,12-13H2,1-2H3,(H,24,25)


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