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

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

Systemtic Name:1-[(4-ethylphenyl)-phenyl-methyl]piperidine-3-carboxylic acid
Openeye Name:1-[(4-ethylphenyl)-phenyl-methyl]piperidine-3-carboxylic acid
CAS Name:1-[(4-ethylphenyl)-phenylmethyl]-3-piperidinecarboxylic acid
IUPAC Name:1-[(4-ethylphenyl)-phenylmethyl]piperidine-3-carboxylic acid
Traditional Name:1-[(4-ethylphenyl)-phenyl-methyl]nipecotic acid
Formula: C21H25NO2
MolecularWeight: 323.4287
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCCC(C3)C(=O)O


Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCCC(C3)C(=O)O


InChI

InChI=1S/C21H25NO2/c1-2-16-10-12-18(13-11-16)20(17-7-4-3-5-8-17)22-14-6-9-19(15-22)21(23)24/h3-5,7-8,10-13,19-20H,2,6,9,14-15H2,1H3,(H,23,24)


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