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

Systemtic Name: 2-(4-chloranyl-2-nitro-phenoxy)-1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)ethanone Openeye Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-chloro-2-nitro-phenoxy)ethanone CAS Name: 2-(4-chloro-2-nitrophenoxy)-1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)ethanone IUPAC Name: 2-(4-chloro-2-nitrophenoxy)-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone Traditional Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-chloro-2-nitro-phenoxy)ethanone Formula: C17H17ClN2O4 MolecularWeight: 348.78088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O4/c1-4-7-19-11(2)8-14(12(19)3)16(21)10-24-17-6-5-13(18)9-15(17)20(22)23/h4-6,8-9H,1,7,10H2,2-3H3