methyl (8aR)-8a-butyl-5-(4-methoxyphenyl)-7-oxidanylidene-1,2,3,8-tetrahydroindolizine-6-carboxylate

Systemtic Name: methyl (8aR)-8a-butyl-5-(4-methoxyphenyl)-7-oxidanylidene-1,2,3,8-tetrahydroindolizine-6-carboxylate Openeye Name: methyl (8aR)-8a-butyl-5-(4-methoxyphenyl)-7-oxo-1,2,3,8-tetrahydroindolizine-6-carboxylate CAS Name: (8aR)-8a-butyl-5-(4-methoxyphenyl)-7-oxo-1,2,3,8-tetrahydroindolizine-6-carboxylic acid methyl ester IUPAC Name: methyl (8aR)-8a-butyl-5-(4-methoxyphenyl)-7-oxo-1,2,3,8-tetrahydroindolizine-6-carboxylate Traditional Name: (8aR)-8a-butyl-7-keto-5-(4-methoxyphenyl)-1,2,3,8-tetrahydroindolizine-6-carboxylic acid methyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC12CCCN1C(=C(C(=O)C2)C(=O)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC[C@]12CCCN1C(=C(C(=O)C2)C(=O)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27NO4/c1-4-5-11-21-12-6-13-22(21)19(15-7-9-16(25-2)10-8-15)18(17(23)14-21)20(24)26-3/h7-10H,4-6,11-14H2,1-3H3/t21-/m1/s1