5,5-dimethyl-3-nitro-8,9-dihydro-7H-benzo[7]annulen-6-one

Systemtic Name: 5,5-dimethyl-3-nitro-8,9-dihydro-7H-benzo[7]annulen-6-one Openeye Name: 5,5-dimethyl-3-nitro-8,9-dihydro-7H-benzo[7]annulen-6-one CAS Name: 5,5-dimethyl-3-nitro-8,9-dihydro-7H-benzo[7]annulen-6-one IUPAC Name: 5,5-dimethyl-3-nitro-8,9-dihydro-7H-benzo[7]annulen-6-one Traditional Name: 5,5-dimethyl-3-nitro-8,9-dihydro-7H-benzocyclohepten-6-one Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)CCCC2=C1C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1(C(=O)CCCC2=C1C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H15NO3/c1-13(2)11-8-10(14(16)17)7-6-9(11)4-3-5-12(13)15/h6-8H,3-5H2,1-2H3