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

Systemtic Name: 2-methylpropyl (4R,7R)-4-(4-ethylphenyl)-2-methyl-5-oxidanylidene-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: isobutyl (4R,7R)-4-(4-ethylphenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,7R)-4-(4-ethylphenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (4R,7R)-4-(4-ethylphenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,7R)-4-(4-ethylphenyl)-5-keto-2-methyl-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid isobutyl ester Formula: C29H33NO3 MolecularWeight: 443.57722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C3C(=NC(=C2C(=O)OCC(C)C)C)CC(CC3=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]2C3C(=NC(=C2C(=O)OCC(C)C)C)C[C@H](CC3=O)C4=CC=CC=C4

InChI

InChI=1S/C29H33NO3/c1-5-20-11-13-22(14-12-20)27-26(29(32)33-17-18(2)3)19(4)30-24-15-23(16-25(31)28(24)27)21-9-7-6-8-10-21/h6-14,18,23,27-28H,5,15-17H2,1-4H3/t23-,27-,28?/m1/s1