N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-7-fluoranyl-2-methyl-quinoline-3-carboxamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-7-fluoranyl-2-methyl-quinoline-3-carboxamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-7-fluoro-2-methyl-quinoline-3-carboxamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-7-fluoro-2-methyl-3-quinolinecarboxamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-7-fluoro-2-methylquinoline-3-carboxamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-7-fluoro-2-methyl-quinoline-3-carboxamide Formula: C20H17BrFN3O2 MolecularWeight: 430.270283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=C(N=C3C=C(C=CC3=C2)F)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=C(N=C3C=C(C=CC3=C2)F)C

InChI

InChI=1S/C20H17BrFN3O2/c1-11-7-14(21)4-6-17(11)25-19(26)10-23-20(27)16-8-13-3-5-15(22)9-18(13)24-12(16)2/h3-9H,10H2,1-2H3,(H,23,27)(H,25,26)