1-methyl-6,8-dinitro-4-(2-oxidanylidenepropyl)quinolin-2-one

Systemtic Name: 1-methyl-6,8-dinitro-4-(2-oxidanylidenepropyl)quinolin-2-one Openeye Name: 4-acetonyl-1-methyl-6,8-dinitro-quinolin-2-one CAS Name: 1-methyl-6,8-dinitro-4-(2-oxopropyl)-2-quinolinone IUPAC Name: 1-methyl-6,8-dinitro-4-(2-oxopropyl)quinolin-2-one Traditional Name: 4-acetonyl-1-methyl-6,8-dinitro-carbostyril Formula: C13H11N3O6 MolecularWeight: 305.24294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=CC(=O)N(C2=C(C=C(C=C12)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC(=O)CC1=CC(=O)N(C2=C(C=C(C=C12)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C13H11N3O6/c1-7(17)3-8-4-12(18)14(2)13-10(8)5-9(15(19)20)6-11(13)16(21)22/h4-6H,3H2,1-2H3