propan-2-yl (4R)-2,7,7-trimethyl-5-oxidanylidene-4-(2-propoxyphenyl)-4,4a,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: propan-2-yl (4R)-2,7,7-trimethyl-5-oxidanylidene-4-(2-propoxyphenyl)-4,4a,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: isopropyl (4R)-2,7,7-trimethyl-5-oxo-4-(2-propoxyphenyl)-4,4a,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4R)-2,7,7-trimethyl-5-oxo-4-(2-propoxyphenyl)-4,4a,6,8-tetrahydroquinoline-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (4R)-2,7,7-trimethyl-5-oxo-4-(2-propoxyphenyl)-4,4a,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4R)-5-keto-2,7,7-trimethyl-4-(2-propoxyphenyl)-4,4a,6,8-tetrahydroquinoline-3-carboxylic acid isopropyl ester Formula: C25H33NO4 MolecularWeight: 411.53382

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2C3C(=NC(=C2C(=O)OC(C)C)C)CC(CC3=O)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H33NO4/c1-7-12-29-20-11-9-8-10-17(20)22-21(24(28)30-15(2)3)16(4)26-18-13-25(5,6)14-19(27)23(18)22/h8-11,15,22-23H,7,12-14H2,1-6H3/t22-,23?/m1/s1