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4-[3-(3-methoxyphenyl)-1-(phenylmethyl)piperidin-3-yl]benzoic acid

4-[3-(3-methoxyphenyl)-1-(phenylmethyl)piperidin-3-yl]benzoic acid

Systemtic Name:4-[3-(3-methoxyphenyl)-1-(phenylmethyl)piperidin-3-yl]benzoic acid
Openeye Name:4-[1-benzyl-3-(3-methoxyphenyl)-3-piperidyl]benzoic acid
CAS Name:4-[3-(3-methoxyphenyl)-1-(phenylmethyl)-3-piperidinyl]benzoic acid
IUPAC Name:4-[1-benzyl-3-(3-methoxyphenyl)piperidin-3-yl]benzoic acid
Traditional Name:4-[1-benzyl-3-(3-methoxyphenyl)-3-piperidyl]benzoic acid
Formula: C26H27NO3
MolecularWeight: 401.49748
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCCN(C2)CC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)O


Isomeric SMILES

COC1=CC=CC(=C1)C2(CCCN(C2)CC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C26H27NO3/c1-30-24-10-5-9-23(17-24)26(22-13-11-21(12-14-22)25(28)29)15-6-16-27(19-26)18-20-7-3-2-4-8-20/h2-5,7-14,17H,6,15-16,18-19H2,1H3,(H,28,29)


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