7-[5,6-bis(azanyl)pyridin-3-yl]-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[5,6-bis(azanyl)pyridin-3-yl]-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(5,6-diamino-3-pyridyl)-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(5,6-diamino-3-pyridinyl)-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(5,6-diaminopyridin-3-yl)-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(5,6-diamino-3-pyridyl)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC(=C(N=C4)N)N

Isomeric SMILES

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC(=C(N=C4)N)N

InChI

InChI=1S/C19H18N4O3/c1-9-12(10-6-15(20)18(21)22-7-10)4-5-13-16(9)23(11-2-3-11)8-14(17(13)24)19(25)26/h4-8,11H,2-3,20H2,1H3,(H2,21,22)(H,25,26)