7-[5-(1-azanylpropan-2-yl)-2,2-dimethyl-pyrrolidin-1-yl]-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[5-(1-azanylpropan-2-yl)-2,2-dimethyl-pyrrolidin-1-yl]-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[5-(2-amino-1-methyl-ethyl)-2,2-dimethyl-pyrrolidin-1-yl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[5-(1-aminopropan-2-yl)-2,2-dimethyl-1-pyrrolidinyl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[5-(1-aminopropan-2-yl)-2,2-dimethylpyrrolidin-1-yl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[5-(2-amino-1-methyl-ethyl)-2,2-dimethyl-pyrrolidino]-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:

CC(CN)C1CCC(N1C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)O)(C)C

Isomeric SMILES

CC(CN)C1CCC(N1C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)O)(C)C

InChI

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