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1-[(3,4-dichlorophenyl)-(4-dimethylaminophenyl)methyl]piperidine-3-carboxylic acid

1-[(3,4-dichlorophenyl)-(4-dimethylaminophenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name:1-[(3,4-dichlorophenyl)-(4-dimethylaminophenyl)methyl]piperidine-3-carboxylic acid
Openeye Name:1-[(3,4-dichlorophenyl)-(4-dimethylaminophenyl)methyl]piperidine-3-carboxylic acid
CAS Name:1-[(3,4-dichlorophenyl)-(4-dimethylaminophenyl)methyl]-3-piperidinecarboxylic acid
IUPAC Name:1-[(3,4-dichlorophenyl)-(4-dimethylaminophenyl)methyl]piperidine-3-carboxylic acid
Traditional Name:1-[(3,4-dichlorophenyl)-(4-dimethylaminophenyl)methyl]nipecotic acid
Formula: C21H24Cl2N2O2
MolecularWeight: 407.33346
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H24Cl2N2O2/c1-24(2)17-8-5-14(6-9-17)20(15-7-10-18(22)19(23)12-15)25-11-3-4-16(13-25)21(26)27/h5-10,12,16,20H,3-4,11,13H2,1-2H3,(H,26,27)


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