4-[(4-butylpiperidin-1-yl)-phenyl-methyl]benzoic acid

Systemtic Name: 4-[(4-butylpiperidin-1-yl)-phenyl-methyl]benzoic acid Openeye Name: 4-[(4-butyl-1-piperidyl)-phenyl-methyl]benzoic acid CAS Name: 4-[(4-butyl-1-piperidinyl)-phenylmethyl]benzoic acid IUPAC Name: 4-[(4-butylpiperidin-1-yl)-phenylmethyl]benzoic acid Traditional Name: 4-[(4-butylpiperidino)-phenyl-methyl]benzoic acid Formula: C23H29NO2 MolecularWeight: 351.48186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCC1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H29NO2/c1-2-3-7-18-14-16-24(17-15-18)22(19-8-5-4-6-9-19)20-10-12-21(13-11-20)23(25)26/h4-6,8-13,18,22H,2-3,7,14-17H2,1H3,(H,25,26)