3,6-dimethyl-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-quinoline-4-carboxylic acid

Systemtic Name: 3,6-dimethyl-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-quinoline-4-carboxylic acid Openeye Name: 3,6-dimethyl-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-quinoline-4-carboxylic acid CAS Name: 3,6-dimethyl-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-quinoline-4-carboxylic acid IUPAC Name: 3,6-dimethyl-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-quinoline-4-carboxylic acid Traditional Name: 2-(4-ketocyclohexa-2,5-dien-1-ylidene)-3,6-dimethyl-1H-quinoline-4-carboxylic acid Formula: C18H15NO3 MolecularWeight: 293.3166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C3C=CC(=O)C=C3)C(=C2C(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C3C=CC(=O)C=C3)C(=C2C(=O)O)C

InChI

InChI=1S/C18H15NO3/c1-10-3-8-15-14(9-10)16(18(21)22)11(2)17(19-15)12-4-6-13(20)7-5-12/h3-9,19H,1-2H3,(H,21,22)