N-[4-[[4-(8-fluoranyl-2-methyl-6-oxidanyl-quinolin-7-yl)carbonylphenyl]carbonylamino]azepan-3-yl]pyridine-4-carboxamide

Systemtic Name: N-[4-[[4-(8-fluoranyl-2-methyl-6-oxidanyl-quinolin-7-yl)carbonylphenyl]carbonylamino]azepan-3-yl]pyridine-4-carboxamide Openeye Name: N-[4-[[4-(8-fluoro-6-hydroxy-2-methyl-quinoline-7-carbonyl)benzoyl]amino]azepan-3-yl]pyridine-4-carboxamide CAS Name: N-[4-[[[4-[(8-fluoro-6-hydroxy-2-methyl-7-quinolinyl)-oxomethyl]phenyl]-oxomethyl]amino]-3-azepanyl]-4-pyridinecarboxamide IUPAC Name: N-[4-[[4-(8-fluoro-6-hydroxy-2-methylquinoline-7-carbonyl)benzoyl]amino]azepan-3-yl]pyridine-4-carboxamide Traditional Name: N-[4-[[4-(8-fluoro-6-hydroxy-2-methyl-quinoline-7-carbonyl)benzoyl]amino]azepan-3-yl]isonicotinamide Formula: C30H28FN5O4 MolecularWeight: 541.572823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C(C=C2C=C1)O)C(=O)C3=CC=C(C=C3)C(=O)NC4CCCNCC4NC(=O)C5=CC=NC=C5)F

Isomeric SMILES

CC1=NC2=C(C(=C(C=C2C=C1)O)C(=O)C3=CC=C(C=C3)C(=O)NC4CCCNCC4NC(=O)C5=CC=NC=C5)F

InChI

InChI=1S/C30H28FN5O4/c1-17-4-5-21-15-24(37)25(26(31)27(21)34-17)28(38)18-6-8-19(9-7-18)29(39)35-22-3-2-12-33-16-23(22)36-30(40)20-10-13-32-14-11-20/h4-11,13-15,22-23,33,37H,2-3,12,16H2,1H3,(H,35,39)(H,36,40)