O3-methyl O1,O2-dipropan-2-yl pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylate

Systemtic Name: O3-methyl O1,O2-dipropan-2-yl pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylate Openeye Name: O1,O2-diisopropyl O3-methyl pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylate CAS Name: pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylic acid O3-methyl ester O1,O2-dipropan-2-yl ester IUPAC Name: 3-O-methyl 1-O,2-O-dipropan-2-yl pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylate Traditional Name: pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylic acid O1,O2-diisopropyl ester O3-methyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C2C3=CC=CC=C3C=NN2C(=C1C(=O)OC(C)C)C(=O)OC

Isomeric SMILES

CC(C)OC(=O)C1=C2C3=CC=CC=C3C=NN2C(=C1C(=O)OC(C)C)C(=O)OC

InChI

InChI=1S/C21H22N2O6/c1-11(2)28-19(24)15-16(20(25)29-12(3)4)18(21(26)27-5)23-17(15)14-9-7-6-8-13(14)10-22-23/h6-12H,1-5H3