O5,O6-dibutyl O1-tert-butyl 4,5,6,7-tetrahydro-2H-isoindole-1,5,6-tricarboxylate

Systemtic Name: O5,O6-dibutyl O1-tert-butyl 4,5,6,7-tetrahydro-2H-isoindole-1,5,6-tricarboxylate Openeye Name: O5,O6-dibutyl O1-tert-butyl 4,5,6,7-tetrahydro-2H-isoindole-1,5,6-tricarboxylate CAS Name: 4,5,6,7-tetrahydro-2H-isoindole-1,5,6-tricarboxylic acid O5,O6-dibutyl ester O1-tert-butyl ester IUPAC Name: 5-O,6-O-dibutyl 1-O-tert-butyl 4,5,6,7-tetrahydro-2H-isoindole-1,5,6-tricarboxylate Traditional Name: 4,5,6,7-tetrahydro-2H-isoindole-1,5,6-tricarboxylic acid O5,O6-dibutyl ester O1-tert-butyl ester Formula: C23H35NO6 MolecularWeight: 421.5271

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CC2=CNC(=C2CC1C(=O)OCCCC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCOC(=O)C1CC2=CNC(=C2CC1C(=O)OCCCC)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H35NO6/c1-6-8-10-28-20(25)17-12-15-14-24-19(22(27)30-23(3,4)5)16(15)13-18(17)21(26)29-11-9-7-2/h14,17-18,24H,6-13H2,1-5H3