1-[1-[(3-isocyanophenyl)methyl]azetidin-2-yl]-2-[(2-methyl-1-naphthalen-2-yl-propan-2-yl)amino]ethanol

Systemtic Name: 1-[1-[(3-isocyanophenyl)methyl]azetidin-2-yl]-2-[(2-methyl-1-naphthalen-2-yl-propan-2-yl)amino]ethanol Openeye Name: 2-[[1,1-dimethyl-2-(2-naphthyl)ethyl]amino]-1-[1-[(3-isocyanophenyl)methyl]azetidin-2-yl]ethanol CAS Name: 1-[1-[(3-isocyanophenyl)methyl]-2-azetidinyl]-2-[[2-methyl-1-(2-naphthalenyl)propan-2-yl]amino]ethanol IUPAC Name: 1-[1-[(3-isocyanophenyl)methyl]azetidin-2-yl]-2-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]ethanol Traditional Name: 2-[[1,1-dimethyl-2-(2-naphthyl)ethyl]amino]-1-[1-(3-isocyanobenzyl)azetidin-2-yl]ethanol Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC2=CC=CC=C2C=C1)NCC(C3CCN3CC4=CC(=CC=C4)[N+]#[C-])O

Isomeric SMILES

CC(C)(CC1=CC2=CC=CC=C2C=C1)NCC(C3CCN3CC4=CC(=CC=C4)[N+]#[C-])O

InChI

InChI=1S/C27H31N3O/c1-27(2,17-20-11-12-22-8-4-5-9-23(22)15-20)29-18-26(31)25-13-14-30(25)19-21-7-6-10-24(16-21)28-3/h4-12,15-16,25-26,29,31H,13-14,17-19H2,1-2H3