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

Systemtic Name: 7-[(6-chloranylpyrazin-2-yl)-(pyridin-4-ylmethyl)amino]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(6-chloropyrazin-2-yl)-(4-pyridylmethyl)amino]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(6-chloro-2-pyrazinyl)-(pyridin-4-ylmethyl)amino]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(6-chloropyrazin-2-yl)-(pyridin-4-ylmethyl)amino]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(6-chloropyrazin-2-yl)-(4-pyridylmethyl)amino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C23H17ClFN5O3 MolecularWeight: 465.864183

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(CC4=CC=NC=C4)C5=CN=CC(=N5)Cl)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(CC4=CC=NC=C4)C5=CN=CC(=N5)Cl)F)C(=O)O

InChI

InChI=1S/C23H17ClFN5O3/c24-20-9-27-10-21(28-20)30(11-13-3-5-26-6-4-13)19-8-18-15(7-17(19)25)22(31)16(23(32)33)12-29(18)14-1-2-14/h3-10,12,14H,1-2,11H2,(H,32,33)