2-methylpropyl 4-(2-bromanyl-4,5-dimethoxy-phenyl)-2-methylidene-5-oxidanylidene-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: 2-methylpropyl 4-(2-bromanyl-4,5-dimethoxy-phenyl)-2-methylidene-5-oxidanylidene-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: isobutyl 4-(2-bromo-4,5-dimethoxy-phenyl)-2-methylene-5-oxo-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(2-bromo-4,5-dimethoxyphenyl)-2-methylene-5-oxo-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methylidene-5-oxo-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(2-bromo-4,5-dimethoxy-phenyl)-5-keto-2-methylene-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid isobutyl ester Formula: C29H32BrNO5 MolecularWeight: 554.47208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC1=C)C4=CC(=C(C=C4Br)OC)OC

Isomeric SMILES

CC(C)COC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC1=C)C4=CC(=C(C=C4Br)OC)OC

InChI

InChI=1S/C29H32BrNO5/c1-16(2)15-36-29(33)26-17(3)31-22-11-19(18-9-7-6-8-10-18)12-23(32)28(22)27(26)20-13-24(34-4)25(35-5)14-21(20)30/h6-10,13-14,16,19,26-27,31H,3,11-12,15H2,1-2,4-5H3