6-chloranyl-1-cyclopropyl-4-oxidanylidene-7-[4-(3-oxidanylidenebutyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-cyclopropyl-4-oxidanylidene-7-[4-(3-oxidanylidenebutyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylic acid Openeye Name: 6-chloro-1-cyclopropyl-4-oxo-7-[4-(3-oxobutyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylic acid CAS Name: 6-chloro-1-cyclopropyl-4-oxo-7-[4-(3-oxobutyl)-1-piperazinyl]-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 6-chloro-1-cyclopropyl-4-oxo-7-[4-(3-oxobutyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylic acid Traditional Name: 6-chloro-1-cyclopropyl-4-keto-7-[4-(3-ketobutyl)piperazino]-1,8-naphthyridine-3-carboxylic acid Formula: C20H23ClN4O4 MolecularWeight: 418.87402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1CCN(CC1)C2=C(C=C3C(=O)C(=CN(C3=N2)C4CC4)C(=O)O)Cl

Isomeric SMILES

CC(=O)CCN1CCN(CC1)C2=C(C=C3C(=O)C(=CN(C3=N2)C4CC4)C(=O)O)Cl

InChI

InChI=1S/C20H23ClN4O4/c1-12(26)4-5-23-6-8-24(9-7-23)19-16(21)10-14-17(27)15(20(28)29)11-25(13-2-3-13)18(14)22-19/h10-11,13H,2-9H2,1H3,(H,28,29)