5-azanyl-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-3-methyl-piperidin-1-yl]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-3-methyl-piperidin-1-yl]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-3-methyl-1-piperidyl]-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-3-methyl-1-piperidinyl]-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-3-methylpiperidin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-3-methyl-piperidino]-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C25H33FN4O4 MolecularWeight: 472.552323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(CCC1NC2CC2)C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)OC)C

Isomeric SMILES

CCC1(CN(CCC1NC2CC2)C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)OC)C

InChI

InChI=1S/C25H33FN4O4/c1-4-25(2)12-29(10-9-16(25)28-13-5-6-13)21-18(26)19(27)17-20(23(21)34-3)30(14-7-8-14)11-15(22(17)31)24(32)33/h11,13-14,16,28H,4-10,12,27H2,1-3H3,(H,32,33)