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

Systemtic Name: 5-azanyl-7-[5,6-bis(azanyl)pyridin-3-yl]-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-(5,6-diamino-3-pyridyl)-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-(5,6-diamino-3-pyridinyl)-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-(5,6-diaminopyridin-3-yl)-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-(5,6-diamino-3-pyridyl)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1C3=CC(=C(N=C3)N)N)N)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1C3=CC(=C(N=C3)N)N)N)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C19H19N5O3/c1-8-11(9-4-14(21)18(22)23-6-9)5-13(20)15-16(8)24(10-2-3-10)7-12(17(15)25)19(26)27/h4-7,10H,2-3,20-21H2,1H3,(H2,22,23)(H,26,27)