[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [5-(2-furyl)isoxazol-3-yl]methyl 3-hexyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-hexyl-4-oxo-1-phthalazinecarboxylic acid [5-(2-furanyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-hexyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-hexyl-4-keto-phthalazine-1-carboxylic acid [5-(2-furyl)isoxazol-3-yl]methyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=NOC(=C3)C4=CC=CO4

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=NOC(=C3)C4=CC=CO4

InChI

InChI=1S/C23H23N3O5/c1-2-3-4-7-12-26-22(27)18-10-6-5-9-17(18)21(24-26)23(28)30-15-16-14-20(31-25-16)19-11-8-13-29-19/h5-6,8-11,13-14H,2-4,7,12,15H2,1H3