(E)-3-[4-(3-methylbutoxy)phenyl]-2-[(2-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile

Systemtic Name: (E)-3-[4-(3-methylbutoxy)phenyl]-2-[(2-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile Openeye Name: (E)-3-(4-isopentyloxyphenyl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[4-(3-methylbutoxy)phenyl]-2-[(2-methyl-1H-indol-3-yl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[4-(3-methylbutoxy)phenyl]-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(4-isoamoxyphenyl)-2-(2-methyl-1H-indole-3-carbonyl)acrylonitrile Formula: C24H24N2O2 MolecularWeight: 372.45956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CC=C(C=C3)OCCC(C)C)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)/C(=C/C3=CC=C(C=C3)OCCC(C)C)/C#N

InChI

InChI=1S/C24H24N2O2/c1-16(2)12-13-28-20-10-8-18(9-11-20)14-19(15-25)24(27)23-17(3)26-22-7-5-4-6-21(22)23/h4-11,14,16,26H,12-13H2,1-3H3/b19-14+