[4-[1-oxidanyl-2-[4-(phenylmethyl)piperidin-1-yl]propyl]phenyl] benzoate

Systemtic Name: [4-[1-oxidanyl-2-[4-(phenylmethyl)piperidin-1-yl]propyl]phenyl] benzoate Openeye Name: [4-[2-(4-benzyl-1-piperidyl)-1-hydroxy-propyl]phenyl] benzoate CAS Name: benzoic acid [4-[1-hydroxy-2-[4-(phenylmethyl)-1-piperidinyl]propyl]phenyl] ester IUPAC Name: [4-[2-(4-benzylpiperidin-1-yl)-1-hydroxypropyl]phenyl] benzoate Traditional Name: benzoic acid [4-[2-(4-benzylpiperidino)-1-hydroxy-propyl]phenyl] ester Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C(C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H31NO3/c1-21(29-18-16-23(17-19-29)20-22-8-4-2-5-9-22)27(30)24-12-14-26(15-13-24)32-28(31)25-10-6-3-7-11-25/h2-15,21,23,27,30H,16-20H2,1H3