sodium 8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[(3S)-3-oxidanylpyrrolidin-1-yl]quinoline-3-carboxylate

Systemtic Name: sodium 8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[(3S)-3-oxidanylpyrrolidin-1-yl]quinoline-3-carboxylate Openeye Name: sodium 8-chloro-1-cyclopropyl-6-fluoro-7-[(3S)-3-hydroxypyrrolidin-1-yl]-4-oxo-quinoline-3-carboxylate CAS Name: sodium 8-chloro-1-cyclopropyl-6-fluoro-7-[(3S)-3-hydroxy-1-pyrrolidinyl]-4-oxo-3-quinolinecarboxylate IUPAC Name: sodium 8-chloro-1-cyclopropyl-6-fluoro-7-[(3S)-3-hydroxypyrrolidin-1-yl]-4-oxoquinoline-3-carboxylate Traditional Name: sodium 8-chloro-1-cyclopropyl-6-fluoro-7-[(3S)-3-hydroxypyrrolidino]-4-keto-quinoline-3-carboxylate Formula: C17H15ClFN2NaO4 MolecularWeight: 388.753173

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)N4CCC(C4)O)F)C(=O)[O-].[Na+]

Isomeric SMILES

C1CN(C[C@H]1O)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)[O-])C4CC4)F.[Na+]

InChI

InChI=1S/C17H16ClFN2O4.Na/c18-13-14-10(5-12(19)15(13)20-4-3-9(22)6-20)16(23)11(17(24)25)7-21(14)8-1-2-8;/h5,7-9,22H,1-4,6H2,(H,24,25);/q;+1/p-1/t9-;/m0./s1