methyl 4-[[1-[2-(4-cyanophenoxy)ethyl]-4-oxidanyl-piperidin-4-yl]methyl-methyl-amino]benzoate

Systemtic Name: methyl 4-[[1-[2-(4-cyanophenoxy)ethyl]-4-oxidanyl-piperidin-4-yl]methyl-methyl-amino]benzoate Openeye Name: methyl 4-[[1-[2-(4-cyanophenoxy)ethyl]-4-hydroxy-4-piperidyl]methyl-methyl-amino]benzoate CAS Name: 4-[[1-[2-(4-cyanophenoxy)ethyl]-4-hydroxy-4-piperidinyl]methyl-methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-[2-(4-cyanophenoxy)ethyl]-4-hydroxypiperidin-4-yl]methyl-methylamino]benzoate Traditional Name: 4-[[1-[2-(4-cyanophenoxy)ethyl]-4-hydroxy-4-piperidyl]methyl-methyl-amino]benzoic acid methyl ester Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1(CCN(CC1)CCOC2=CC=C(C=C2)C#N)O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN(CC1(CCN(CC1)CCOC2=CC=C(C=C2)C#N)O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C24H29N3O4/c1-26(21-7-5-20(6-8-21)23(28)30-2)18-24(29)11-13-27(14-12-24)15-16-31-22-9-3-19(17-25)4-10-22/h3-10,29H,11-16,18H2,1-2H3