(E)-3-(2-chloranyl-5-nitro-phenyl)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2-chloranyl-5-nitro-phenyl)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(2-chloro-5-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-3-(2-chloro-5-nitrophenyl)-2-[(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(2-chloro-5-nitrophenyl)-2-(2,5-dimethyl-1-prop-2-enylpyrrole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(2-chloro-5-nitro-phenyl)acrylonitrile Formula: C19H16ClN3O3 MolecularWeight: 369.80164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)C(=CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C#N

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)/C(=C/C2=C(C=CC(=C2)[N+](=O)[O-])Cl)/C#N

InChI

InChI=1S/C19H16ClN3O3/c1-4-7-22-12(2)8-17(13(22)3)19(24)15(11-21)9-14-10-16(23(25)26)5-6-18(14)20/h4-6,8-10H,1,7H2,2-3H3/b15-9+