N-[(3-methoxy-4-prop-2-enoxy-phenyl)methyl]-4-oxidanylidene-N-[[(2R)-oxolan-2-yl]methyl]-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(3-methoxy-4-prop-2-enoxy-phenyl)methyl]-4-oxidanylidene-N-[[(2R)-oxolan-2-yl]methyl]-3H-phthalazine-1-carboxamide Openeye Name: N-[(4-allyloxy-3-methoxy-phenyl)methyl]-4-oxo-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-3H-phthalazine-1-carboxamide CAS Name: N-[(3-methoxy-4-prop-2-enoxyphenyl)methyl]-4-oxo-N-[[(2R)-2-oxolanyl]methyl]-3H-phthalazine-1-carboxamide IUPAC Name: N-[(3-methoxy-4-prop-2-enoxyphenyl)methyl]-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-3H-phthalazine-1-carboxamide Traditional Name: N-(4-allyloxy-3-methoxy-benzyl)-4-keto-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-3H-phthalazine-1-carboxamide Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(CC2CCCO2)C(=O)C3=NNC(=O)C4=CC=CC=C43)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)CN(C[C@H]2CCCO2)C(=O)C3=NNC(=O)C4=CC=CC=C43)OCC=C

InChI

InChI=1S/C25H27N3O5/c1-3-12-33-21-11-10-17(14-22(21)31-2)15-28(16-18-7-6-13-32-18)25(30)23-19-8-4-5-9-20(19)24(29)27-26-23/h3-5,8-11,14,18H,1,6-7,12-13,15-16H2,2H3,(H,27,29)/t18-/m1/s1