5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-7-[2-(4-hydroxyphenyl)ethylamino]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-7-[2-(4-hydroxyphenyl)ethylamino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-[2-(4-hydroxyphenyl)ethylamino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-[2-(4-hydroxyphenyl)ethylamino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-[2-(4-hydroxyphenyl)ethylamino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-[2-(4-hydroxyphenyl)ethylamino]-4-keto-quinoline-3-carboxylic acid Formula: C21H19F2N3O4 MolecularWeight: 415.390066

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C2C(=C(C(=C3N)F)NCCC4=CC=C(C=C4)O)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C2C(=C(C(=C3N)F)NCCC4=CC=C(C=C4)O)F)C(=O)O

InChI

InChI=1S/C21H19F2N3O4/c22-15-17(24)14-19(26(11-3-4-11)9-13(20(14)28)21(29)30)16(23)18(15)25-8-7-10-1-5-12(27)6-2-10/h1-2,5-6,9,11,25,27H,3-4,7-8,24H2,(H,29,30)