7-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-[3-(aminomethyl)-3-methyl-1-pyrrolidinyl]-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-[3-(aminomethyl)-3-methyl-pyrrolidino]-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H22F2N4O3 MolecularWeight: 392.399786

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F)CN

Isomeric SMILES

CC1(CCN(C1)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F)CN

InChI

InChI=1S/C19H22F2N4O3/c1-19(7-22)4-5-24(8-19)16-12(20)14(23)11-15(13(16)21)25(9-2-3-9)6-10(17(11)26)18(27)28/h6,9H,2-5,7-8,22-23H2,1H3,(H,27,28)