7-chloranyl-1-(dimethylamino)-2-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-chloranyl-1-(dimethylamino)-2-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-chloro-1-(dimethylamino)-2-methyl-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-chloro-1-(dimethylamino)-2-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-chloro-1-(dimethylamino)-2-methyl-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-chloro-1-(dimethylamino)-4-keto-2-methyl-6-nitro-quinoline-3-carboxylic acid Formula: C13H12ClN3O5 MolecularWeight: 325.70448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC(=C(C=C2N1N(C)C)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(=O)C2=CC(=C(C=C2N1N(C)C)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H12ClN3O5/c1-6-11(13(19)20)12(18)7-4-10(17(21)22)8(14)5-9(7)16(6)15(2)3/h4-5H,1-3H3,(H,19,20)