3-[1-(diphenylmethyl)azetidin-3-yl]oxy-1-(2-oxidanylpropylamino)indole-2-carbonitrile

Systemtic Name: 3-[1-(diphenylmethyl)azetidin-3-yl]oxy-1-(2-oxidanylpropylamino)indole-2-carbonitrile Openeye Name: 3-(1-benzhydrylazetidin-3-yl)oxy-1-(2-hydroxypropylamino)indole-2-carbonitrile CAS Name: 3-[[1-(diphenylmethyl)-3-azetidinyl]oxy]-1-(2-hydroxypropylamino)-2-indolecarbonitrile IUPAC Name: 3-(1-benzhydrylazetidin-3-yl)oxy-1-(2-hydroxypropylamino)indole-2-carbonitrile Traditional Name: 3-(1-benzhydrylazetidin-3-yl)oxy-1-(2-hydroxypropylamino)indole-2-carbonitrile Formula: C28H28N4O2 MolecularWeight: 452.54752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNN1C2=CC=CC=C2C(=C1C#N)OC3CN(C3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CC(CNN1C2=CC=CC=C2C(=C1C#N)OC3CN(C3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C28H28N4O2/c1-20(33)17-30-32-25-15-9-8-14-24(25)28(26(32)16-29)34-23-18-31(19-23)27(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,20,23,27,30,33H,17-19H2,1H3