(E)-2-(1-methyl-2-phenyl-indol-3-yl)carbonyl-3-(2-prop-2-ynoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(1-methyl-2-phenyl-indol-3-yl)carbonyl-3-(2-prop-2-ynoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(1-methyl-2-phenyl-indole-3-carbonyl)-3-(2-prop-2-ynoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(1-methyl-2-phenyl-3-indolyl)-oxomethyl]-3-(2-prop-2-ynoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(1-methyl-2-phenylindole-3-carbonyl)-3-(2-prop-2-ynoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(1-methyl-2-phenyl-indole-3-carbonyl)-3-(2-propargyloxyphenyl)acrylonitrile Formula: C28H20N2O2 MolecularWeight: 416.4706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)C(=CC4=CC=CC=C4OCC#C)C#N

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)/C(=C/C4=CC=CC=C4OCC#C)/C#N

InChI

InChI=1S/C28H20N2O2/c1-3-17-32-25-16-10-7-13-21(25)18-22(19-29)28(31)26-23-14-8-9-15-24(23)30(2)27(26)20-11-5-4-6-12-20/h1,4-16,18H,17H2,2H3/b22-18+