7-(2-azanylethylamino)-1-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(2-azanylethylamino)-1-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(2-aminoethylamino)-1-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2-aminoethylamino)-1-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2-aminoethylamino)-1-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(2-aminoethylamino)-4-keto-1-methyl-quinoline-3-carboxylic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=C(C=C2)NCCN)C(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=C(C=C2)NCCN)C(=O)O

InChI

InChI=1S/C13H15N3O3/c1-16-7-10(13(18)19)12(17)9-3-2-8(6-11(9)16)15-5-4-14/h2-3,6-7,15H,4-5,14H2,1H3,(H,18,19)