7-(dimethylaminodiazenyl)-1-octyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(dimethylaminodiazenyl)-1-octyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(dimethylaminoazo)-1-octyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(dimethylaminoazo)-1-octyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(dimethylaminodiazenyl)-1-octyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(dimethylaminoazo)-4-keto-1-octyl-quinoline-3-carboxylic acid Formula: C20H28N4O3 MolecularWeight: 372.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=C(C(=O)C2=C1C=C(C=C2)N=NN(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCN1C=C(C(=O)C2=C1C=C(C=C2)N=NN(C)C)C(=O)O

InChI

InChI=1S/C20H28N4O3/c1-4-5-6-7-8-9-12-24-14-17(20(26)27)19(25)16-11-10-15(13-18(16)24)21-22-23(2)3/h10-11,13-14H,4-9,12H2,1-3H3,(H,26,27)