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

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-7-methoxy-2-methyl-quinoline-3-carboxamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-7-methoxy-2-methyl-quinoline-3-carboxamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-7-methoxy-2-methyl-3-quinolinecarboxamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-7-methoxy-2-methylquinoline-3-carboxamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-7-methoxy-2-methyl-quinoline-3-carboxamide Formula: C21H20BrN3O3 MolecularWeight: 442.3058

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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)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C21H20BrN3O3/c1-12-8-15(22)5-7-18(12)25-20(26)11-23-21(27)17-9-14-4-6-16(28-3)10-19(14)24-13(17)2/h4-10H,11H2,1-3H3,(H,23,27)(H,25,26)