(E)-2-(2,3-dihydroindol-1-ylcarbonyl)-3-(3-ethoxy-4-phenylmethoxy-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(2,3-dihydroindol-1-ylcarbonyl)-3-(3-ethoxy-4-phenylmethoxy-phenyl)prop-2-enenitrile Openeye Name: (E)-3-(4-benzyloxy-3-ethoxy-phenyl)-2-(indoline-1-carbonyl)prop-2-enenitrile CAS Name: (E)-2-[2,3-dihydroindol-1-yl(oxo)methyl]-3-(3-ethoxy-4-phenylmethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2,3-dihydroindole-1-carbonyl)-3-(3-ethoxy-4-phenylmethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-3-(4-benzoxy-3-ethoxy-phenyl)-2-(indoline-1-carbonyl)acrylonitrile Formula: C27H24N2O3 MolecularWeight: 424.49106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)N2CCC3=CC=CC=C32)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)N2CCC3=CC=CC=C32)OCC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O3/c1-2-31-26-17-21(12-13-25(26)32-19-20-8-4-3-5-9-20)16-23(18-28)27(30)29-15-14-22-10-6-7-11-24(22)29/h3-13,16-17H,2,14-15,19H2,1H3/b23-16+