2-[[4-[2-[methyl-(4-propan-2-yloxyphenyl)amino]ethyl]-4-oxidanyl-piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[2-[methyl-(4-propan-2-yloxyphenyl)amino]ethyl]-4-oxidanyl-piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[4-hydroxy-4-[2-(4-isopropoxy-N-methyl-anilino)ethyl]-1-piperidyl]methyl]benzonitrile CAS Name: 2-[[4-hydroxy-4-[2-(N-methyl-4-propan-2-yloxyanilino)ethyl]-1-piperidinyl]methyl]benzonitrile IUPAC Name: 2-[[4-hydroxy-4-[2-(N-methyl-4-propan-2-yloxyanilino)ethyl]piperidin-1-yl]methyl]benzonitrile Traditional Name: 2-[[4-hydroxy-4-[2-(4-isopropoxy-N-methyl-anilino)ethyl]piperidino]methyl]benzonitrile Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)N(C)CCC2(CCN(CC2)CC3=CC=CC=C3C#N)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)N(C)CCC2(CCN(CC2)CC3=CC=CC=C3C#N)O

InChI

InChI=1S/C25H33N3O2/c1-20(2)30-24-10-8-23(9-11-24)27(3)15-12-25(29)13-16-28(17-14-25)19-22-7-5-4-6-21(22)18-26/h4-11,20,29H,12-17,19H2,1-3H3