7-(2-azanyl-5-methyl-2-propan-2-yl-piperidin-1-yl)-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(2-azanyl-5-methyl-2-propan-2-yl-piperidin-1-yl)-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(2-amino-2-isopropyl-5-methyl-1-piperidyl)-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2-amino-5-methyl-2-propan-2-yl-1-piperidinyl)-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2-amino-5-methyl-2-propan-2-ylpiperidin-1-yl)-8-chloro-1-cyclopropyl-6-hydroxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(2-amino-2-isopropyl-5-methyl-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:

CC1CCC(N(C1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)O)(C(C)C)N

Isomeric SMILES

CC1CCC(N(C1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)O)(C(C)C)N

InChI

InChI=1S/C22H28ClN3O4/c1-11(2)22(24)7-6-12(3)9-26(22)19-16(27)8-14-18(17(19)23)25(13-4-5-13)10-15(20(14)28)21(29)30/h8,10-13,27H,4-7,9,24H2,1-3H3,(H,29,30)