(E)-3-[4-(cyanomethoxy)phenyl]-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-[(2,5-dimethyl-1-propyl-3-pyrrolyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-(2,5-dimethyl-1-propylpyrrole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)acrylonitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O2/c1-4-10-24-15(2)12-20(16(24)3)21(25)18(14-23)13-17-5-7-19(8-6-17)26-11-9-22/h5-8,12-13H,4,10-11H2,1-3H3/b18-13+