8-methyl-8a-(3-methyl-4-nitro-phenyl)carbonyl-5,8-dihydro-4aH-naphthalene-1,4-dione

Systemtic Name: 8-methyl-8a-(3-methyl-4-nitro-phenyl)carbonyl-5,8-dihydro-4aH-naphthalene-1,4-dione Openeye Name: 8-methyl-8a-(3-methyl-4-nitro-benzoyl)-5,8-dihydro-4aH-naphthalene-1,4-dione CAS Name: 8-methyl-8a-[(3-methyl-4-nitrophenyl)-oxomethyl]-5,8-dihydro-4aH-naphthalene-1,4-dione IUPAC Name: 8-methyl-8a-(3-methyl-4-nitrobenzoyl)-5,8-dihydro-4aH-naphthalene-1,4-dione Traditional Name: 8-methyl-8a-(3-methyl-4-nitro-benzoyl)-5,8-dihydro-4aH-naphthalene-1,4-quinone Formula: C19H17NO5 MolecularWeight: 339.34198

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCC2C1(C(=O)C=CC2=O)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1C=CCC2C1(C(=O)C=CC2=O)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H17NO5/c1-11-10-13(6-7-15(11)20(24)25)18(23)19-12(2)4-3-5-14(19)16(21)8-9-17(19)22/h3-4,6-10,12,14H,5H2,1-2H3