N-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-4-(4-methylpiperidin-1-yl)phthalazin-1-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-4-(4-methylpiperidin-1-yl)phthalazin-1-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-4-(4-methyl-1-piperidyl)phthalazin-1-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-4-(4-methyl-1-piperidinyl)-1-phthalazinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-4-(4-methylpiperidin-1-yl)phthalazin-1-amine Traditional Name: [6-chloro-4-(4-methylpiperidino)phthalazin-1-yl]-piperonyl-amine Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(C3=C2C=C(C=C3)Cl)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(C3=C2C=C(C=C3)Cl)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H23ClN4O2/c1-14-6-8-27(9-7-14)22-18-11-16(23)3-4-17(18)21(25-26-22)24-12-15-2-5-19-20(10-15)29-13-28-19/h2-5,10-11,14H,6-9,12-13H2,1H3,(H,24,25)