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

Systemtic Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-3-(3-ethoxy-2-methoxy-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(3-ethoxy-2-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-[(2,5-dimethyl-1-propyl-3-pyrrolyl)-oxomethyl]-3-(3-ethoxy-2-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2,5-dimethyl-1-propylpyrrole-3-carbonyl)-3-(3-ethoxy-2-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(3-ethoxy-2-methoxy-phenyl)acrylonitrile Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O3/c1-6-11-24-15(3)12-19(16(24)4)21(25)18(14-23)13-17-9-8-10-20(27-7-2)22(17)26-5/h8-10,12-13H,6-7,11H2,1-5H3/b18-13+