(E)-4-[4-[(3-bromophenyl)amino]-3-cyano-7-methoxy-quinolin-6-yl]-N,N-dimethyl-but-2-enamide

Systemtic Name: (E)-4-[4-[(3-bromophenyl)amino]-3-cyano-7-methoxy-quinolin-6-yl]-N,N-dimethyl-but-2-enamide Openeye Name: (E)-4-[4-(3-bromoanilino)-3-cyano-7-methoxy-6-quinolyl]-N,N-dimethyl-but-2-enamide CAS Name: (E)-4-[4-(3-bromoanilino)-3-cyano-7-methoxy-6-quinolinyl]-N,N-dimethyl-2-butenamide IUPAC Name: (E)-4-[4-(3-bromoanilino)-3-cyano-7-methoxyquinolin-6-yl]-N,N-dimethylbut-2-enamide Traditional Name: (E)-4-[4-(3-bromoanilino)-3-cyano-7-methoxy-6-quinolyl]-N,N-dimethyl-but-2-enamide Formula: C23H21BrN4O2 MolecularWeight: 465.34244

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C=CCC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br)OC

Isomeric SMILES

CN(C)C(=O)/C=C/CC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C23H21BrN4O2/c1-28(2)22(29)9-4-6-15-10-19-20(12-21(15)30-3)26-14-16(13-25)23(19)27-18-8-5-7-17(24)11-18/h4-5,7-12,14H,6H2,1-3H3,(H,26,27)/b9-4+