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

Systemtic Name: 5-azanyl-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-piperidin-1-yl]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-1-piperidyl]-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-1-piperidinyl]-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethylpiperidin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-[4-(cyclopropylamino)-3-ethyl-piperidino]-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C24H31FN4O4 MolecularWeight: 458.525743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCC1NC2CC2)C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)OC

Isomeric SMILES

CCC1CN(CCC1NC2CC2)C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)OC

InChI

InChI=1S/C24H31FN4O4/c1-3-12-10-28(9-8-16(12)27-13-4-5-13)21-18(25)19(26)17-20(23(21)33-2)29(14-6-7-14)11-15(22(17)30)24(31)32/h11-14,16,27H,3-10,26H2,1-2H3,(H,31,32)