2-[[methyl-[(4-piperidin-1-ylphenyl)methyl]amino]methyl]phthalazin-1-one

Systemtic Name: 2-[[methyl-[(4-piperidin-1-ylphenyl)methyl]amino]methyl]phthalazin-1-one Openeye Name: 2-[[methyl-[[4-(1-piperidyl)phenyl]methyl]amino]methyl]phthalazin-1-one CAS Name: 2-[[methyl-[[4-(1-piperidinyl)phenyl]methyl]amino]methyl]-1-phthalazinone IUPAC Name: 2-[[methyl-[(4-piperidin-1-ylphenyl)methyl]amino]methyl]phthalazin-1-one Traditional Name: 2-[[methyl-(4-piperidinobenzyl)amino]methyl]phthalazin-1-one Formula: C22H26N4O MolecularWeight: 362.46804

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C22H26N4O/c1-24(17-26-22(27)21-8-4-3-7-19(21)15-23-26)16-18-9-11-20(12-10-18)25-13-5-2-6-14-25/h3-4,7-12,15H,2,5-6,13-14,16-17H2,1H3