6,6-dimethyl-3-nitro-7,8,9,10-tetrahydrobenzo[8]annulen-5-one

Systemtic Name: 6,6-dimethyl-3-nitro-7,8,9,10-tetrahydrobenzo[8]annulen-5-one Openeye Name: 6,6-dimethyl-3-nitro-7,8,9,10-tetrahydrobenzo[8]annulen-5-one CAS Name: 6,6-dimethyl-3-nitro-7,8,9,10-tetrahydrobenzo[8]annulen-5-one IUPAC Name: 6,6-dimethyl-3-nitro-7,8,9,10-tetrahydrobenzo[8]annulen-5-one Traditional Name: 6,6-dimethyl-3-nitro-7,8,9,10-tetrahydrobenzocycloocten-5-one Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1(CCCCC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H17NO3/c1-14(2)8-4-3-5-10-6-7-11(15(17)18)9-12(10)13(14)16/h6-7,9H,3-5,8H2,1-2H3