[1-[phenyl(piperidin-1-yl)methyl]naphthalen-2-yl] 4-tert-butylbenzoate

Systemtic Name: [1-[phenyl(piperidin-1-yl)methyl]naphthalen-2-yl] 4-tert-butylbenzoate Openeye Name: [1-[phenyl(1-piperidyl)methyl]-2-naphthyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [1-[phenyl(1-piperidinyl)methyl]-2-naphthalenyl] ester IUPAC Name: [1-[phenyl(piperidin-1-yl)methyl]naphthalen-2-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [1-[phenyl(piperidino)methyl]-2-naphthyl] ester Formula: C33H35NO2 MolecularWeight: 477.6365

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)C(C4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)C(C4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C33H35NO2/c1-33(2,3)27-19-16-26(17-20-27)32(35)36-29-21-18-24-12-8-9-15-28(24)30(29)31(25-13-6-4-7-14-25)34-22-10-5-11-23-34/h4,6-9,12-21,31H,5,10-11,22-23H2,1-3H3