6-azanyl-8-methoxy-1-methyl-4-oxidanylidene-7-(4-pyridin-2-ylpiperazin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 6-azanyl-8-methoxy-1-methyl-4-oxidanylidene-7-(4-pyridin-2-ylpiperazin-1-yl)quinoline-3-carboxylic acid Openeye Name: 6-amino-8-methoxy-1-methyl-4-oxo-7-[4-(2-pyridyl)piperazin-1-yl]quinoline-3-carboxylic acid CAS Name: 6-amino-8-methoxy-1-methyl-4-oxo-7-[4-(2-pyridinyl)-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 6-amino-8-methoxy-1-methyl-4-oxo-7-(4-pyridin-2-ylpiperazin-1-yl)quinoline-3-carboxylic acid Traditional Name: 6-amino-4-keto-8-methoxy-1-methyl-7-[4-(2-pyridyl)piperazino]quinoline-3-carboxylic acid Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=CC(=C(C(=C21)OC)N3CCN(CC3)C4=CC=CC=N4)N)C(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=CC(=C(C(=C21)OC)N3CCN(CC3)C4=CC=CC=N4)N)C(=O)O

InChI

InChI=1S/C21H23N5O4/c1-24-12-14(21(28)29)19(27)13-11-15(22)18(20(30-2)17(13)24)26-9-7-25(8-10-26)16-5-3-4-6-23-16/h3-6,11-12H,7-10,22H2,1-2H3,(H,28,29)