2-phenyl-6-[1-[[1-(phenylmethyl)piperidin-4-yl]amino]ethyl]benzoic acid

Systemtic Name: 2-phenyl-6-[1-[[1-(phenylmethyl)piperidin-4-yl]amino]ethyl]benzoic acid Openeye Name: 2-[1-[(1-benzyl-4-piperidyl)amino]ethyl]-6-phenyl-benzoic acid CAS Name: 2-phenyl-6-[1-[[1-(phenylmethyl)-4-piperidinyl]amino]ethyl]benzoic acid IUPAC Name: 2-[1-[(1-benzylpiperidin-4-yl)amino]ethyl]-6-phenylbenzoic acid Traditional Name: 2-[1-[(1-benzyl-4-piperidyl)amino]ethyl]-6-phenyl-benzoic acid Formula: C27H30N2O2 MolecularWeight: 414.5393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1C(=O)O)C2=CC=CC=C2)NC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC(=C1C(=O)O)C2=CC=CC=C2)NC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O2/c1-20(28-23-15-17-29(18-16-23)19-21-9-4-2-5-10-21)24-13-8-14-25(26(24)27(30)31)22-11-6-3-7-12-22/h2-14,20,23,28H,15-19H2,1H3,(H,30,31)