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

Systemtic Name: 2-[1-[2-naphthalen-2-ylethanoyl-[1-(phenylmethyl)piperidin-4-yl]amino]ethyl]-6-phenyl-benzoic acid Openeye Name: 2-[1-[(1-benzyl-4-piperidyl)-[2-(2-naphthyl)acetyl]amino]ethyl]-6-phenyl-benzoic acid CAS Name: 2-[1-[[2-(2-naphthalenyl)-1-oxoethyl]-[1-(phenylmethyl)-4-piperidinyl]amino]ethyl]-6-phenylbenzoic acid IUPAC Name: 2-[1-[(1-benzylpiperidin-4-yl)-(2-naphthalen-2-ylacetyl)amino]ethyl]-6-phenylbenzoic acid Traditional Name: 2-[1-[(1-benzyl-4-piperidyl)-[2-(2-naphthyl)acetyl]amino]ethyl]-6-phenyl-benzoic acid Formula: C39H38N2O3 MolecularWeight: 582.73062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1C(=O)O)C2=CC=CC=C2)N(C3CCN(CC3)CC4=CC=CC=C4)C(=O)CC5=CC6=CC=CC=C6C=C5

Isomeric SMILES

CC(C1=CC=CC(=C1C(=O)O)C2=CC=CC=C2)N(C3CCN(CC3)CC4=CC=CC=C4)C(=O)CC5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C39H38N2O3/c1-28(35-17-10-18-36(38(35)39(43)44)32-14-6-3-7-15-32)41(34-21-23-40(24-22-34)27-29-11-4-2-5-12-29)37(42)26-30-19-20-31-13-8-9-16-33(31)25-30/h2-20,25,28,34H,21-24,26-27H2,1H3,(H,43,44)