7-(5-azanyl-3,3-diethyl-piperidin-1-yl)-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(5-azanyl-3,3-diethyl-piperidin-1-yl)-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(5-amino-3,3-diethyl-1-piperidyl)-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(5-amino-3,3-diethyl-1-piperidinyl)-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(5-amino-3,3-diethylpiperidin-1-yl)-8-chloro-1-cyclopropyl-6-hydroxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(5-amino-3,3-diethyl-piperidino)-8-chloro-1-cyclopropyl-6-hydroxy-4-keto-quinoline-3-carboxylic acid Formula: C22H28ClN3O4 MolecularWeight: 433.92842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CN(C1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)O)N)CC

Isomeric SMILES

CCC1(CC(CN(C1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)O)N)CC

InChI

InChI=1S/C22H28ClN3O4/c1-3-22(4-2)8-12(24)9-25(11-22)19-16(27)7-14-18(17(19)23)26(13-5-6-13)10-15(20(14)28)21(29)30/h7,10,12-13,27H,3-6,8-9,11,24H2,1-2H3,(H,29,30)