1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanone

Systemtic Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanone Openeye Name: 2-(2-allyl-4-nitro-phenoxy)-1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone CAS Name: 1-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-(4-nitro-2-prop-2-enylphenoxy)ethanone IUPAC Name: 1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-(4-nitro-2-prop-2-enylphenoxy)ethanone Traditional Name: 2-(2-allyl-4-nitro-phenoxy)-1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])CC=C

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])CC=C

InChI

InChI=1S/C20H22N2O4/c1-4-5-15-11-17(22(24)25)8-9-20(15)26-12-19(23)18-10-13(2)21(14(18)3)16-6-7-16/h4,8-11,16H,1,5-7,12H2,2-3H3