O5-methyl O2-pentyl (5S,6S)-3,6-dimethyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2,5-dicarboxylate

Systemtic Name: O5-methyl O2-pentyl (5S,6S)-3,6-dimethyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2,5-dicarboxylate Openeye Name: O5-methyl O2-pentyl (5S,6S)-3,6-dimethyl-4-oxo-1,5,6,7-tetrahydroindole-2,5-dicarboxylate CAS Name: (5S,6S)-3,6-dimethyl-4-oxo-1,5,6,7-tetrahydroindole-2,5-dicarboxylic acid O5-methyl ester O2-pentyl ester IUPAC Name: 5-O-methyl 2-O-pentyl (5S,6S)-3,6-dimethyl-4-oxo-1,5,6,7-tetrahydroindole-2,5-dicarboxylate Traditional Name: (5S,6S)-4-keto-3,6-dimethyl-1,5,6,7-tetrahydroindole-2,5-dicarboxylic acid O2-amyl ester O5-methyl ester Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C2=C(N1)CC(C(C2=O)C(=O)OC)C)C

Isomeric SMILES

CCCCCOC(=O)C1=C(C2=C(N1)C[C@@H]([C@@H](C2=O)C(=O)OC)C)C

InChI

InChI=1S/C18H25NO5/c1-5-6-7-8-24-18(22)15-11(3)14-12(19-15)9-10(2)13(16(14)20)17(21)23-4/h10,13,19H,5-9H2,1-4H3/t10-,13-/m0/s1