[5-[4-[4-(diphenylmethyl)oxypiperidin-1-yl]-1-oxidanyl-butyl]-2-propyl-phenyl] 2-methylpropanoate

Systemtic Name: [5-[4-[4-(diphenylmethyl)oxypiperidin-1-yl]-1-oxidanyl-butyl]-2-propyl-phenyl] 2-methylpropanoate Openeye Name: [5-[4-(4-benzhydryloxy-1-piperidyl)-1-hydroxy-butyl]-2-propyl-phenyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [5-[4-[4-(diphenylmethyl)oxy-1-piperidinyl]-1-hydroxybutyl]-2-propylphenyl] ester IUPAC Name: [5-[4-(4-benzhydryloxypiperidin-1-yl)-1-hydroxybutyl]-2-propylphenyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [5-[4-(4-benzhydryloxypiperidino)-1-hydroxy-butyl]-2-propyl-phenyl] ester Formula: C35H45NO4 MolecularWeight: 543.7361

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C(CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4)O)OC(=O)C(C)C

Isomeric SMILES

CCCC1=C(C=C(C=C1)C(CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4)O)OC(=O)C(C)C

InChI

InChI=1S/C35H45NO4/c1-4-12-27-18-19-30(25-33(27)40-35(38)26(2)3)32(37)17-11-22-36-23-20-31(21-24-36)39-34(28-13-7-5-8-14-28)29-15-9-6-10-16-29/h5-10,13-16,18-19,25-26,31-32,34,37H,4,11-12,17,20-24H2,1-3H3