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

Systemtic Name: (phenylmethyl) (4R,7R)-2-methyl-5-oxidanylidene-7-phenyl-4-(2-propoxyphenyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: benzyl (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 (phenylmethyl) ester IUPAC Name: benzyl (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 benzyl ester Formula: C33H33NO4 MolecularWeight: 507.61942

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2C3C(=NC(=C2C(=O)OCC4=CC=CC=C4)C)CC(CC3=O)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=CC=C1[C@H]2C3C(=NC(=C2C(=O)OCC4=CC=CC=C4)C)C[C@H](CC3=O)C5=CC=CC=C5

InChI

InChI=1S/C33H33NO4/c1-3-18-37-29-17-11-10-16-26(29)31-30(33(36)38-21-23-12-6-4-7-13-23)22(2)34-27-19-25(20-28(35)32(27)31)24-14-8-5-9-15-24/h4-17,25,31-32H,3,18-21H2,1-2H3/t25-,31-,32?/m1/s1