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

Systemtic Name: 2-phenoxyethyl (4R,7R)-4-(3-methoxy-4-propoxy-phenyl)-2-methyl-5-oxidanylidene-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: 2-phenoxyethyl (4R,7R)-4-(3-methoxy-4-propoxy-phenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,7R)-4-(3-methoxy-4-propoxyphenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (4R,7R)-4-(3-methoxy-4-propoxyphenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,7R)-5-keto-4-(3-methoxy-4-propoxy-phenyl)-2-methyl-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid 2-phenoxyethyl ester Formula: C35H37NO6 MolecularWeight: 567.67138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C3C(=NC(=C2C(=O)OCCOC4=CC=CC=C4)C)CC(CC3=O)C5=CC=CC=C5)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H]2C3C(=NC(=C2C(=O)OCCOC4=CC=CC=C4)C)C[C@H](CC3=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C35H37NO6/c1-4-17-41-30-16-15-25(22-31(30)39-3)33-32(35(38)42-19-18-40-27-13-9-6-10-14-27)23(2)36-28-20-26(21-29(37)34(28)33)24-11-7-5-8-12-24/h5-16,22,26,33-34H,4,17-21H2,1-3H3/t26-,33-,34?/m1/s1