2-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-5-methyl-8-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 2-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-5-methyl-8-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-5-methyl-8-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-[3-(aminomethyl)-3-methyl-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-5-methyl-8-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-5-methyl-8-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-[3-(aminomethyl)-3-methyl-pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-5-methyl-8-nitro-quinoline-3-carboxylic acid Formula: C20H23FN4O5 MolecularWeight: 418.418823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C2=C1C(=O)C(=C(N2C3CC3)N4CCC(C4)(C)CN)C(=O)O)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C2=C1C(=O)C(=C(N2C3CC3)N4CCC(C4)(C)CN)C(=O)O)[N+](=O)[O-])F

InChI

InChI=1S/C20H23FN4O5/c1-10-12(21)7-13(25(29)30)16-14(10)17(26)15(19(27)28)18(24(16)11-3-4-11)23-6-5-20(2,8-22)9-23/h7,11H,3-6,8-9,22H2,1-2H3,(H,27,28)