(3R)-3-methyl-3-[(E)-2-nitroethenyl]oxan-2-one

Systemtic Name: (3R)-3-methyl-3-[(E)-2-nitroethenyl]oxan-2-one Openeye Name: (3R)-3-methyl-3-[(E)-2-nitrovinyl]tetrahydropyran-2-one CAS Name: (3R)-3-methyl-3-[(E)-2-nitroethenyl]-2-oxanone IUPAC Name: (3R)-3-methyl-3-[(E)-2-nitroethenyl]oxan-2-one Traditional Name: (3R)-3-methyl-3-[(E)-2-nitrovinyl]tetrahydropyran-2-one Formula: C8H11NO4 MolecularWeight: 185.17724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCOC1=O)C=C[N+](=O)[O-]

Isomeric SMILES

C[C@@]1(CCCOC1=O)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C8H11NO4/c1-8(4-5-9(11)12)3-2-6-13-7(8)10/h4-5H,2-3,6H2,1H3/b5-4+/t8-/m1/s1