methyl 4-bromanyl-5-methyl-5-nitro-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: methyl 4-bromanyl-5-methyl-5-nitro-cyclohexa-1,3-diene-1-carboxylate Openeye Name: methyl 4-bromo-5-methyl-5-nitro-cyclohexa-1,3-diene-1-carboxylate CAS Name: 4-bromo-5-methyl-5-nitro-1-cyclohexa-1,3-dienecarboxylic acid methyl ester IUPAC Name: methyl 4-bromo-5-methyl-5-nitrocyclohexa-1,3-diene-1-carboxylate Traditional Name: 4-bromo-5-methyl-5-nitro-cyclohexa-1,3-diene-1-carboxylic acid methyl ester Formula: C9H10BrNO4 MolecularWeight: 276.084

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC=C1Br)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1(CC(=CC=C1Br)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C9H10BrNO4/c1-9(11(13)14)5-6(8(12)15-2)3-4-7(9)10/h3-4H,5H2,1-2H3