8-(1,3-benzodioxol-5-yl)-6-(2-piperidin-1-ylethyl)-[1,3]dioxolo[4,5-g]phthalazin-5-one

Systemtic Name: 8-(1,3-benzodioxol-5-yl)-6-(2-piperidin-1-ylethyl)-[1,3]dioxolo[4,5-g]phthalazin-5-one Openeye Name: 8-(1,3-benzodioxol-5-yl)-6-[2-(1-piperidyl)ethyl]-[1,3]dioxolo[4,5-g]phthalazin-5-one CAS Name: 8-(1,3-benzodioxol-5-yl)-6-[2-(1-piperidinyl)ethyl]-[1,3]dioxolo[4,5-g]phthalazin-5-one IUPAC Name: 8-(1,3-benzodioxol-5-yl)-6-(2-piperidin-1-ylethyl)-[1,3]dioxolo[4,5-g]phthalazin-5-one Traditional Name: 8-(1,3-benzodioxol-5-yl)-6-(2-piperidinoethyl)-[1,3]dioxolo[4,5-g]phthalazin-5-one Formula: C23H23N3O5 MolecularWeight: 421.44582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN2C(=O)C3=CC4=C(C=C3C(=N2)C5=CC6=C(C=C5)OCO6)OCO4

Isomeric SMILES

C1CCN(CC1)CCN2C(=O)C3=CC4=C(C=C3C(=N2)C5=CC6=C(C=C5)OCO6)OCO4

InChI

InChI=1S/C23H23N3O5/c27-23-17-12-21-20(30-14-31-21)11-16(17)22(15-4-5-18-19(10-15)29-13-28-18)24-26(23)9-8-25-6-2-1-3-7-25/h4-5,10-12H,1-3,6-9,13-14H2