(2,3-dimethoxyphenyl)methyl 4-oxidanylidene-3-pentyl-phthalazine-1-carboxylate

Systemtic Name: (2,3-dimethoxyphenyl)methyl 4-oxidanylidene-3-pentyl-phthalazine-1-carboxylate Openeye Name: (2,3-dimethoxyphenyl)methyl 4-oxo-3-pentyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-pentyl-1-phthalazinecarboxylic acid (2,3-dimethoxyphenyl)methyl ester IUPAC Name: (2,3-dimethoxyphenyl)methyl 4-oxo-3-pentylphthalazine-1-carboxylate Traditional Name: 3-amyl-4-keto-phthalazine-1-carboxylic acid o-veratryl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C23H26N2O5/c1-4-5-8-14-25-22(26)18-12-7-6-11-17(18)20(24-25)23(27)30-15-16-10-9-13-19(28-2)21(16)29-3/h6-7,9-13H,4-5,8,14-15H2,1-3H3