cyclohexyl (4R,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: cyclohexyl (4R,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: cyclohexyl (4R,7S)-2-methyl-4-(5-methyl-2-furyl)-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,7S)-2-methyl-4-(5-methyl-2-furanyl)-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl (4R,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,7S)-5-keto-2-methyl-4-(5-methyl-2-furyl)-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclohexyl ester Formula: C28H31NO4 MolecularWeight: 445.55004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2C3C(=NC(=C2C(=O)OC4CCCCC4)C)CC(CC3=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(O1)[C@@H]2C3C(=NC(=C2C(=O)OC4CCCCC4)C)C[C@@H](CC3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H31NO4/c1-17-13-14-24(32-17)27-25(28(31)33-21-11-7-4-8-12-21)18(2)29-22-15-20(16-23(30)26(22)27)19-9-5-3-6-10-19/h3,5-6,9-10,13-14,20-21,26-27H,4,7-8,11-12,15-16H2,1-2H3/t20-,26?,27-/m0/s1