[(6S)-3-ethanoyl-4-oxidanylidene-7,12-dihydro-6H-indolo[2,3-a]quinolizin-6-yl]methyl 3-oxidanylidenebutanoate

Systemtic Name: [(6S)-3-ethanoyl-4-oxidanylidene-7,12-dihydro-6H-indolo[2,3-a]quinolizin-6-yl]methyl 3-oxidanylidenebutanoate Openeye Name: [(6S)-3-acetyl-4-oxo-7,12-dihydro-6H-indolo[2,3-a]quinolizin-6-yl]methyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid [(6S)-3-acetyl-4-oxo-7,12-dihydro-6H-indolo[2,3-a]quinolizin-6-yl]methyl ester IUPAC Name: [(6S)-3-acetyl-4-oxo-7,12-dihydro-6H-indolo[2,3-a]quinolizin-6-yl]methyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid [(6S)-3-acetyl-4-keto-7,12-dihydro-6H-pyrido[2,1-a]$b-carbolin-6-yl]methyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCC1CC2=C(C3=CC=C(C(=O)N13)C(=O)C)NC4=CC=CC=C24

Isomeric SMILES

CC(=O)CC(=O)OC[C@@H]1CC2=C(C3=CC=C(C(=O)N13)C(=O)C)NC4=CC=CC=C24

InChI

InChI=1S/C22H20N2O5/c1-12(25)9-20(27)29-11-14-10-17-16-5-3-4-6-18(16)23-21(17)19-8-7-15(13(2)26)22(28)24(14)19/h3-8,14,23H,9-11H2,1-2H3/t14-/m0/s1