tert-butyl 4-[methyl-[2-[4-oxidanyl-1-(phenylmethyl)piperidin-4-yl]ethyl]amino]benzoate

Systemtic Name: tert-butyl 4-[methyl-[2-[4-oxidanyl-1-(phenylmethyl)piperidin-4-yl]ethyl]amino]benzoate Openeye Name: tert-butyl 4-[2-(1-benzyl-4-hydroxy-4-piperidyl)ethyl-methyl-amino]benzoate CAS Name: 4-[2-[4-hydroxy-1-(phenylmethyl)-4-piperidinyl]ethyl-methylamino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(1-benzyl-4-hydroxypiperidin-4-yl)ethyl-methylamino]benzoate Traditional Name: 4-[2-(1-benzyl-4-hydroxy-4-piperidyl)ethyl-methyl-amino]benzoic acid tert-butyl ester Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)N(C)CCC2(CCN(CC2)CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)N(C)CCC2(CCN(CC2)CC3=CC=CC=C3)O

InChI

InChI=1S/C26H36N2O3/c1-25(2,3)31-24(29)22-10-12-23(13-11-22)27(4)17-14-26(30)15-18-28(19-16-26)20-21-8-6-5-7-9-21/h5-13,30H,14-20H2,1-4H3