(1E)-1-[3-ethanoyl-3-methyl-1-(3-nitrophenyl)pyrrolidin-2-ylidene]propan-2-one

Systemtic Name: (1E)-1-[3-ethanoyl-3-methyl-1-(3-nitrophenyl)pyrrolidin-2-ylidene]propan-2-one Openeye Name: (1E)-1-[3-acetyl-3-methyl-1-(3-nitrophenyl)pyrrolidin-2-ylidene]propan-2-one CAS Name: (1E)-1-[3-acetyl-3-methyl-1-(3-nitrophenyl)-2-pyrrolidinylidene]-2-propanone IUPAC Name: (1E)-1-[3-acetyl-3-methyl-1-(3-nitrophenyl)pyrrolidin-2-ylidene]propan-2-one Traditional Name: (1E)-1-[3-acetyl-3-methyl-1-(3-nitrophenyl)pyrrolidin-2-ylidene]acetone Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=C1C(CCN1C2=CC(=CC=C2)[N+](=O)[O-])(C)C(=O)C

Isomeric SMILES

CC(=O)/C=C/1\C(CCN1C2=CC(=CC=C2)[N+](=O)[O-])(C)C(=O)C

InChI

InChI=1S/C16H18N2O4/c1-11(19)9-15-16(3,12(2)20)7-8-17(15)13-5-4-6-14(10-13)18(21)22/h4-6,9-10H,7-8H2,1-3H3/b15-9+