1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-(4-methoxy-2-nitro-phenoxy)ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-(4-methoxy-2-nitro-phenoxy)ethanone Openeye Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-methoxy-2-nitro-phenoxy)ethanone CAS Name: 1-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-(4-methoxy-2-nitrophenoxy)ethanone IUPAC Name: 1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-(4-methoxy-2-nitrophenoxy)ethanone Traditional Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-methoxy-2-nitro-phenoxy)ethanone Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O5/c1-11(2)19-12(3)8-15(13(19)4)17(21)10-25-18-7-6-14(24-5)9-16(18)20(22)23/h6-9,11H,10H2,1-5H3