(E)-2-(1-ethyl-2-phenyl-indol-3-yl)carbonyl-3-(4-propoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(1-ethyl-2-phenyl-indol-3-yl)carbonyl-3-(4-propoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(1-ethyl-2-phenyl-indole-3-carbonyl)-3-(4-propoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(1-ethyl-2-phenyl-3-indolyl)-oxomethyl]-3-(4-propoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(1-ethyl-2-phenylindole-3-carbonyl)-3-(4-propoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(1-ethyl-2-phenyl-indole-3-carbonyl)-3-(4-propoxyphenyl)acrylonitrile Formula: C29H26N2O2 MolecularWeight: 434.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)C2=C(N(C3=CC=CC=C32)CC)C4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)C2=C(N(C3=CC=CC=C32)CC)C4=CC=CC=C4

InChI

InChI=1S/C29H26N2O2/c1-3-18-33-24-16-14-21(15-17-24)19-23(20-30)29(32)27-25-12-8-9-13-26(25)31(4-2)28(27)22-10-6-5-7-11-22/h5-17,19H,3-4,18H2,1-2H3/b23-19+