ethyl (9S,9aR,10R)-9,9a-dimethyl-9-oxidanyl-6-oxidanylidene-8,10-dihydro-7H-pyrido[1,2-a]indole-10-carboxylate

Systemtic Name: ethyl (9S,9aR,10R)-9,9a-dimethyl-9-oxidanyl-6-oxidanylidene-8,10-dihydro-7H-pyrido[1,2-a]indole-10-carboxylate Openeye Name: ethyl (9S,9aR,10R)-9-hydroxy-9,9a-dimethyl-6-oxo-8,10-dihydro-7H-pyrido[1,2-a]indole-10-carboxylate CAS Name: (9S,9aR,10R)-9-hydroxy-9,9a-dimethyl-6-oxo-8,10-dihydro-7H-pyrido[1,2-a]indole-10-carboxylic acid ethyl ester IUPAC Name: ethyl (9S,9aR,10R)-9-hydroxy-9,9a-dimethyl-6-oxo-8,10-dihydro-7H-pyrido[1,2-a]indole-10-carboxylate Traditional Name: (9S,9aR,10R)-9-hydroxy-6-keto-9,9a-dimethyl-8,10-dihydro-7H-pyrid[1,2-a]indole-10-carboxylic acid ethyl ester Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2=CC=CC=C2N3C1(C(CCC3=O)(C)O)C

Isomeric SMILES

CCOC(=O)[C@@H]1C2=CC=CC=C2N3[C@]1([C@@](CCC3=O)(C)O)C

InChI

InChI=1S/C17H21NO4/c1-4-22-15(20)14-11-7-5-6-8-12(11)18-13(19)9-10-16(2,21)17(14,18)3/h5-8,14,21H,4,9-10H2,1-3H3/t14-,16-,17+/m0/s1