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

Systemtic Name: (E)-3-(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2-[(2,5-dimethyl-1-propyl-3-pyrrolyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2-(2,5-dimethyl-1-propylpyrrole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)acrylonitrile Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN2O3/c1-5-7-24-13(3)8-17(14(24)4)20(25)16(12-23)9-15-10-18(22)21(26)19(11-15)27-6-2/h8-11,26H,5-7H2,1-4H3/b16-9+