3-[2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[4-(coumaran-5-ylmethyl)piperazino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C24H25N5O4 MolecularWeight: 447.4864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)CN4C(=O)C5=CC=CC=C5C(=N4)C(=O)N

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)CN4C(=O)C5=CC=CC=C5C(=N4)C(=O)N

InChI

InChI=1S/C24H25N5O4/c25-23(31)22-18-3-1-2-4-19(18)24(32)29(26-22)15-21(30)28-10-8-27(9-11-28)14-16-5-6-20-17(13-16)7-12-33-20/h1-6,13H,7-12,14-15H2,(H2,25,31)