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

Systemtic Name: cyclohexyl (4R,7R)-2-methyl-5-oxidanylidene-7-phenyl-4-(2-propoxyphenyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: cyclohexyl (4R,7R)-2-methyl-5-oxo-7-phenyl-4-(2-propoxyphenyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,7R)-2-methyl-5-oxo-7-phenyl-4-(2-propoxyphenyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl (4R,7R)-2-methyl-5-oxo-7-phenyl-4-(2-propoxyphenyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,7R)-5-keto-2-methyl-7-phenyl-4-(2-propoxyphenyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclohexyl ester Formula: C32H37NO4 MolecularWeight: 499.64048

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2C3C(=NC(=C2C(=O)OC4CCCCC4)C)CC(CC3=O)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=CC=C1[C@H]2C3C(=NC(=C2C(=O)OC4CCCCC4)C)C[C@H](CC3=O)C5=CC=CC=C5

InChI

InChI=1S/C32H37NO4/c1-3-18-36-28-17-11-10-16-25(28)30-29(32(35)37-24-14-8-5-9-15-24)21(2)33-26-19-23(20-27(34)31(26)30)22-12-6-4-7-13-22/h4,6-7,10-13,16-17,23-24,30-31H,3,5,8-9,14-15,18-20H2,1-2H3/t23-,30-,31?/m1/s1