(E)-1-(2-methyloxiran-2-yl)-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(2-methyloxiran-2-yl)-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-(2-methyloxiran-2-yl)-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-(2-methyl-2-oxiranyl)-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(2-methyloxiran-2-yl)-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(2-methyloxiran-2-yl)-3-(3-nitrophenyl)prop-2-en-1-one Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CO1)C(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1(CO1)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11NO4/c1-12(8-17-12)11(14)6-5-9-3-2-4-10(7-9)13(15)16/h2-7H,8H2,1H3/b6-5+