7-[5-(1-azanylpropan-2-yl)-7-azaspiro[2.4]heptan-2-yl]-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[5-(1-azanylpropan-2-yl)-7-azaspiro[2.4]heptan-2-yl]-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[5-(2-amino-1-methyl-ethyl)-7-azaspiro[2.4]heptan-2-yl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[5-(1-aminopropan-2-yl)-7-azaspiro[2.4]heptan-2-yl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[5-(1-aminopropan-2-yl)-7-azaspiro[2.4]heptan-2-yl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[5-(2-amino-1-methyl-ethyl)-7-azaspiro[2.4]heptan-2-yl]-8-chloro-1-cyclopropyl-6-hydroxy-4-keto-quinoline-3-carboxylic acid Formula: C22H26ClN3O4 MolecularWeight: 431.91254

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)C1CC2(CC2C3=C(C=C4C(=C3Cl)N(C=C(C4=O)C(=O)O)C5CC5)O)NC1

Isomeric SMILES

CC(CN)C1CC2(CC2C3=C(C=C4C(=C3Cl)N(C=C(C4=O)C(=O)O)C5CC5)O)NC1

InChI

InChI=1S/C22H26ClN3O4/c1-10(7-24)11-5-22(25-8-11)6-15(22)17-16(27)4-13-19(18(17)23)26(12-2-3-12)9-14(20(13)28)21(29)30/h4,9-12,15,25,27H,2-3,5-8,24H2,1H3,(H,29,30)