(E)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-3-(4-ethoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-3-(4-ethoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(4-ethoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(2,5-dimethyl-1-propyl-3-pyrrolyl)-oxomethyl]-3-(4-ethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2,5-dimethyl-1-propylpyrrole-3-carbonyl)-3-(4-ethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-p-phenetyl-acrylonitrile Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)C(=CC2=CC=C(C=C2)OCC)C#N)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)/C(=C/C2=CC=C(C=C2)OCC)/C#N)C

InChI

InChI=1S/C21H24N2O2/c1-5-11-23-15(3)12-20(16(23)4)21(24)18(14-22)13-17-7-9-19(10-8-17)25-6-2/h7-10,12-13H,5-6,11H2,1-4H3/b18-13+