N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylpiperidin-1-yl)phthalazine-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylpiperidin-1-yl)phthalazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methyl-1-piperidyl)phthalazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methyl-1-piperidinyl)-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylpiperidin-1-yl)phthalazine-1-carboxamide Traditional Name: 4-(4-methylpiperidino)-N-piperonyl-phthalazine-1-carboxamide Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(C3=CC=CC=C32)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(C3=CC=CC=C32)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H24N4O3/c1-15-8-10-27(11-9-15)22-18-5-3-2-4-17(18)21(25-26-22)23(28)24-13-16-6-7-19-20(12-16)30-14-29-19/h2-7,12,15H,8-11,13-14H2,1H3,(H,24,28)