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

Systemtic Name: (E)-2-[(2-methyl-1H-indol-3-yl)carbonyl]-3-(2-prop-2-ynoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(2-methyl-1H-indole-3-carbonyl)-3-(2-prop-2-ynoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(2-methyl-1H-indol-3-yl)-oxomethyl]-3-(2-prop-2-ynoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2-methyl-1H-indole-3-carbonyl)-3-(2-prop-2-ynoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(2-methyl-1H-indole-3-carbonyl)-3-(2-propargyloxyphenyl)acrylonitrile Formula: C22H16N2O2 MolecularWeight: 340.37464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CC=CC=C3OCC#C)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)/C(=C/C3=CC=CC=C3OCC#C)/C#N

InChI

InChI=1S/C22H16N2O2/c1-3-12-26-20-11-7-4-8-16(20)13-17(14-23)22(25)21-15(2)24-19-10-6-5-9-18(19)21/h1,4-11,13,24H,12H2,2H3/b17-13+