3-[cyclopropyl-[3-[(2-methyl-1-naphthalen-2-yl-propan-2-yl)amino]-2-oxidanyl-propoxy]methyl]benzenecarbonitrile

Systemtic Name: 3-[cyclopropyl-[3-[(2-methyl-1-naphthalen-2-yl-propan-2-yl)amino]-2-oxidanyl-propoxy]methyl]benzenecarbonitrile Openeye Name: 3-[cyclopropyl-[3-[[1,1-dimethyl-2-(2-naphthyl)ethyl]amino]-2-hydroxy-propoxy]methyl]benzonitrile CAS Name: 3-[cyclopropyl-[2-hydroxy-3-[[2-methyl-1-(2-naphthalenyl)propan-2-yl]amino]propoxy]methyl]benzonitrile IUPAC Name: 3-[cyclopropyl-[2-hydroxy-3-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]propoxy]methyl]benzonitrile Traditional Name: 3-[cyclopropyl-[3-[[1,1-dimethyl-2-(2-naphthyl)ethyl]amino]-2-hydroxy-propoxy]methyl]benzonitrile Formula: C28H32N2O2 MolecularWeight: 428.56588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC2=CC=CC=C2C=C1)NCC(COC(C3CC3)C4=CC=CC(=C4)C#N)O

Isomeric SMILES

CC(C)(CC1=CC2=CC=CC=C2C=C1)NCC(COC(C3CC3)C4=CC=CC(=C4)C#N)O

InChI

InChI=1S/C28H32N2O2/c1-28(2,16-20-10-11-22-7-3-4-8-24(22)14-20)30-18-26(31)19-32-27(23-12-13-23)25-9-5-6-21(15-25)17-29/h3-11,14-15,23,26-27,30-31H,12-13,16,18-19H2,1-2H3