2-(5-methoxy-1-phenethyl-indol-3-yl)-2-methyl-propanenitrile

Systemtic Name: 2-(5-methoxy-1-phenethyl-indol-3-yl)-2-methyl-propanenitrile Openeye Name: 2-(5-methoxy-1-phenethyl-indol-3-yl)-2-methyl-propanenitrile CAS Name: 2-(5-methoxy-1-phenethyl-3-indolyl)-2-methylpropanenitrile IUPAC Name: 2-(5-methoxy-1-phenethylindol-3-yl)-2-methylpropanenitrile Traditional Name: 2-(5-methoxy-1-phenethyl-indol-3-yl)-2-methyl-propionitrile Formula: C21H22N2O MolecularWeight: 318.41218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CN(C2=C1C=C(C=C2)OC)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C#N)C1=CN(C2=C1C=C(C=C2)OC)CCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O/c1-21(2,15-22)19-14-23(12-11-16-7-5-4-6-8-16)20-10-9-17(24-3)13-18(19)20/h4-10,13-14H,11-12H2,1-3H3