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

Systemtic Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-3-(3-ethoxy-4-oxidanyl-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(3-ethoxy-4-hydroxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-[(2,5-dimethyl-1-propyl-3-pyrrolyl)-oxomethyl]-3-(3-ethoxy-4-hydroxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2,5-dimethyl-1-propylpyrrole-3-carbonyl)-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(3-ethoxy-4-hydroxy-phenyl)acrylonitrile Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O3/c1-5-9-23-14(3)10-18(15(23)4)21(25)17(13-22)11-16-7-8-19(24)20(12-16)26-6-2/h7-8,10-12,24H,5-6,9H2,1-4H3/b17-11+