2-propan-2-yloxyethyl (4R)-4-(2-bromophenyl)-2,7,7-trimethyl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: 2-propan-2-yloxyethyl (4R)-4-(2-bromophenyl)-2,7,7-trimethyl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: 2-isopropoxyethyl (4R)-4-(2-bromophenyl)-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4R)-4-(2-bromophenyl)-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-propan-2-yloxyethyl ester IUPAC Name: 2-propan-2-yloxyethyl (4R)-4-(2-bromophenyl)-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4R)-4-(2-bromophenyl)-5-keto-2,7,7-trimethyl-3,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-isopropoxyethyl ester Formula: C24H30BrNO4 MolecularWeight: 476.4033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCCOC(C)C)C3=CC=CC=C3Br)C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OCCOC(C)C)C3=CC=CC=C3Br)C(=O)CC(C2)(C)C

InChI

InChI=1S/C24H30BrNO4/c1-14(2)29-10-11-30-23(28)20-15(3)26-18-12-24(4,5)13-19(27)22(18)21(20)16-8-6-7-9-17(16)25/h6-9,14,20-21H,10-13H2,1-5H3/t20?,21-/m1/s1