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1-[(3,4-dimethoxyphenyl)-phenyl-methyl]piperidine-3-carboxylic acid

1-[(3,4-dimethoxyphenyl)-phenyl-methyl]piperidine-3-carboxylic acid

Systemtic Name:1-[(3,4-dimethoxyphenyl)-phenyl-methyl]piperidine-3-carboxylic acid
Openeye Name:1-[(3,4-dimethoxyphenyl)-phenyl-methyl]piperidine-3-carboxylic acid
CAS Name:1-[(3,4-dimethoxyphenyl)-phenylmethyl]-3-piperidinecarboxylic acid
IUPAC Name:1-[(3,4-dimethoxyphenyl)-phenylmethyl]piperidine-3-carboxylic acid
Traditional Name:1-[(3,4-dimethoxyphenyl)-phenyl-methyl]nipecotic acid
Formula: C21H25NO4
MolecularWeight: 355.4275
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=CC=CC=C2)N3CCCC(C3)C(=O)O)OC


Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=CC=CC=C2)N3CCCC(C3)C(=O)O)OC


InChI

InChI=1S/C21H25NO4/c1-25-18-11-10-16(13-19(18)26-2)20(15-7-4-3-5-8-15)22-12-6-9-17(14-22)21(23)24/h3-5,7-8,10-11,13,17,20H,6,9,12,14H2,1-2H3,(H,23,24)


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