7-[(5-bromanylpyridin-2-yl)-naphthalen-2-ylsulfonyl-amino]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(5-bromanylpyridin-2-yl)-naphthalen-2-ylsulfonyl-amino]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(5-bromo-2-pyridyl)-(2-naphthylsulfonyl)amino]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(5-bromo-2-pyridinyl)-(2-naphthalenylsulfonyl)amino]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(5-bromopyridin-2-yl)-naphthalen-2-ylsulfonylamino]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(5-bromo-2-pyridyl)-(2-naphthylsulfonyl)amino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C28H19BrFN3O5S MolecularWeight: 608.434963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(C4=NC=C(C=C4)Br)S(=O)(=O)C5=CC6=CC=CC=C6C=C5)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(C4=NC=C(C=C4)Br)S(=O)(=O)C5=CC6=CC=CC=C6C=C5)F)C(=O)O

InChI

InChI=1S/C28H19BrFN3O5S/c29-18-6-10-26(31-14-18)33(39(37,38)20-9-5-16-3-1-2-4-17(16)11-20)25-13-24-21(12-23(25)30)27(34)22(28(35)36)15-32(24)19-7-8-19/h1-6,9-15,19H,7-8H2,(H,35,36)