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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[naphthalen-2-ylsulfonyl(pyridin-4-ylmethyl)amino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[2-naphthylsulfonyl(4-pyridylmethyl)amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[2-naphthalenylsulfonyl(pyridin-4-ylmethyl)amino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[naphthalen-2-ylsulfonyl(pyridin-4-ylmethyl)amino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[2-naphthylsulfonyl(4-pyridylmethyl)amino]quinoline-3-carboxylic acid Formula: C29H22FN3O5S MolecularWeight: 543.565483

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(CC4=CC=NC=C4)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(CC4=CC=NC=C4)S(=O)(=O)C5=CC6=CC=CC=C6C=C5)F)C(=O)O

InChI

InChI=1S/C29H22FN3O5S/c30-25-14-23-26(32(21-6-7-21)17-24(28(23)34)29(35)36)15-27(25)33(16-18-9-11-31-12-10-18)39(37,38)22-8-5-19-3-1-2-4-20(19)13-22/h1-5,8-15,17,21H,6-7,16H2,(H,35,36)