3-(6-bromanyl-5-methoxy-2-nitro-cyclohexa-2,4-dien-1-yl)-1-methyl-pyrrolidin-2-one

Systemtic Name: 3-(6-bromanyl-5-methoxy-2-nitro-cyclohexa-2,4-dien-1-yl)-1-methyl-pyrrolidin-2-one Openeye Name: 3-(6-bromo-5-methoxy-2-nitro-cyclohexa-2,4-dien-1-yl)-1-methyl-pyrrolidin-2-one CAS Name: 3-(6-bromo-5-methoxy-2-nitro-1-cyclohexa-2,4-dienyl)-1-methyl-2-pyrrolidinone IUPAC Name: 3-(6-bromo-5-methoxy-2-nitrocyclohexa-2,4-dien-1-yl)-1-methylpyrrolidin-2-one Traditional Name: 3-(6-bromo-5-methoxy-2-nitro-cyclohexa-2,4-dien-1-yl)-1-methyl-2-pyrrolidone Formula: C12H15BrN2O4 MolecularWeight: 331.1625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1=O)C2C(C(=CC=C2[N+](=O)[O-])OC)Br

Isomeric SMILES

CN1CCC(C1=O)C2C(C(=CC=C2[N+](=O)[O-])OC)Br

InChI

InChI=1S/C12H15BrN2O4/c1-14-6-5-7(12(14)16)10-8(15(17)18)3-4-9(19-2)11(10)13/h3-4,7,10-11H,5-6H2,1-2H3