5-azanyl-7-(7-azanyl-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophen-2-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-6,7-dihydroquinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-7-(7-azanyl-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophen-2-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-6,7-dihydroquinoline-3-carboxylic acid Openeye Name: 5-amino-7-(7-amino-6,6-dimethyl-5,7-dihydro-4H-benzothiophen-2-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-6,7-dihydroquinoline-3-carboxylic acid CAS Name: 5-amino-7-(7-amino-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophen-2-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-6,7-dihydroquinoline-3-carboxylic acid IUPAC Name: 5-amino-7-(7-amino-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophen-2-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-6,7-dihydroquinoline-3-carboxylic acid Traditional Name: 5-amino-7-(7-amino-6,6-dimethyl-5,7-dihydro-4H-benzothiophen-2-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-keto-6,7-dihydroquinoline-3-carboxylic acid Formula: C23H25ClFN3O3S MolecularWeight: 477.979303

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1N)SC(=C2)C3C(C(=C4C(=C3Cl)N(C=C(C4=O)C(=O)O)C5CC5)N)F)C

Isomeric SMILES

CC1(CCC2=C(C1N)SC(=C2)C3C(C(=C4C(=C3Cl)N(C=C(C4=O)C(=O)O)C5CC5)N)F)C

InChI

InChI=1S/C23H25ClFN3O3S/c1-23(2)6-5-9-7-12(32-20(9)21(23)27)13-15(24)18-14(17(26)16(13)25)19(29)11(22(30)31)8-28(18)10-3-4-10/h7-8,10,13,16,21H,3-6,26-27H2,1-2H3,(H,30,31)