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methyl (4R)-4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxidanylidene-4,4a,6,8-tetrahydroquinoline-3-carboxylate

methyl (4R)-4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxidanylidene-4,4a,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name:methyl (4R)-4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxidanylidene-4,4a,6,8-tetrahydroquinoline-3-carboxylate
Openeye Name:methyl (4R)-4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxo-4,4a,6,8-tetrahydroquinoline-3-carboxylate
CAS Name:(4R)-4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxo-4,4a,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester
IUPAC Name:methyl (4R)-4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxo-4,4a,6,8-tetrahydroquinoline-3-carboxylate
Traditional Name:(4R)-5-keto-2,7,7-trimethyl-4-m-phenetyl-4,4a,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester
Formula: C22H27NO4
MolecularWeight: 369.45408
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2C3C(=NC(=C2C(=O)OC)C)CC(CC3=O)(C)C


Isomeric SMILES

CCOC1=CC=CC(=C1)[C@H]2C3C(=NC(=C2C(=O)OC)C)CC(CC3=O)(C)C


InChI

InChI=1S/C22H27NO4/c1-6-27-15-9-7-8-14(10-15)19-18(21(25)26-5)13(2)23-16-11-22(3,4)12-17(24)20(16)19/h7-10,19-20H,6,11-12H2,1-5H3/t19-,20?/m1/s1


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