butyl 4-(bromomethyl)-2,2-dimethyl-6-phenyl-quinoline-1-carboxylate

Systemtic Name: butyl 4-(bromomethyl)-2,2-dimethyl-6-phenyl-quinoline-1-carboxylate Openeye Name: butyl 4-(bromomethyl)-2,2-dimethyl-6-phenyl-quinoline-1-carboxylate CAS Name: 4-(bromomethyl)-2,2-dimethyl-6-phenyl-1-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 4-(bromomethyl)-2,2-dimethyl-6-phenylquinoline-1-carboxylate Traditional Name: 4-(bromomethyl)-2,2-dimethyl-6-phenyl-quinoline-1-carboxylic acid butyl ester Formula: C23H26BrNO2 MolecularWeight: 428.36204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1C2=C(C=C(C=C2)C3=CC=CC=C3)C(=CC1(C)C)CBr

Isomeric SMILES

CCCCOC(=O)N1C2=C(C=C(C=C2)C3=CC=CC=C3)C(=CC1(C)C)CBr

InChI

InChI=1S/C23H26BrNO2/c1-4-5-13-27-22(26)25-21-12-11-18(17-9-7-6-8-10-17)14-20(21)19(16-24)15-23(25,2)3/h6-12,14-15H,4-5,13,16H2,1-3H3