methyl (3R,3aS,7aR)-1-(4-methoxyphenyl)-5-methyl-3-oxidanyl-2-oxidanylidene-3,3a,4,7-tetrahydroindole-7a-carboxylate

Systemtic Name: methyl (3R,3aS,7aR)-1-(4-methoxyphenyl)-5-methyl-3-oxidanyl-2-oxidanylidene-3,3a,4,7-tetrahydroindole-7a-carboxylate Openeye Name: methyl (3R,3aS,7aR)-3-hydroxy-1-(4-methoxyphenyl)-5-methyl-2-oxo-3,3a,4,7-tetrahydroindole-7a-carboxylate CAS Name: (3R,3aS,7aR)-3-hydroxy-1-(4-methoxyphenyl)-5-methyl-2-oxo-3,3a,4,7-tetrahydroindole-7a-carboxylic acid methyl ester IUPAC Name: methyl (3R,3aS,7aR)-3-hydroxy-1-(4-methoxyphenyl)-5-methyl-2-oxo-3,3a,4,7-tetrahydroindole-7a-carboxylate Traditional Name: (3R,3aS,7aR)-3-hydroxy-2-keto-1-(4-methoxyphenyl)-5-methyl-3,3a,4,7-tetrahydroindole-7a-carboxylic acid methyl ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2(C(C1)C(C(=O)N2C3=CC=C(C=C3)OC)O)C(=O)OC

Isomeric SMILES

CC1=CC[C@@]2([C@H](C1)[C@H](C(=O)N2C3=CC=C(C=C3)OC)O)C(=O)OC

InChI

InChI=1S/C18H21NO5/c1-11-8-9-18(17(22)24-3)14(10-11)15(20)16(21)19(18)12-4-6-13(23-2)7-5-12/h4-8,14-15,20H,9-10H2,1-3H3/t14-,15-,18-/m1/s1