(E)-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-1-(4-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-1-(4-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-1-(4-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-1-(4-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-1-(4-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-1-(4-nitrophenyl)prop-2-en-1-one Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3/c1-12(2)19-13(3)11-16(14(19)4)7-10-18(21)15-5-8-17(9-6-15)20(22)23/h5-12H,1-4H3/b10-7+