2-(2-azanyl-5-piperidin-1-yl-phenyl)-4-methyl-phthalazin-1-one

Systemtic Name: 2-(2-azanyl-5-piperidin-1-yl-phenyl)-4-methyl-phthalazin-1-one Openeye Name: 2-[2-amino-5-(1-piperidyl)phenyl]-4-methyl-phthalazin-1-one CAS Name: 2-[2-amino-5-(1-piperidinyl)phenyl]-4-methyl-1-phthalazinone IUPAC Name: 2-(2-amino-5-piperidin-1-ylphenyl)-4-methylphthalazin-1-one Traditional Name: 2-(2-amino-5-piperidino-phenyl)-4-methyl-phthalazin-1-one Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)C3=C(C=CC(=C3)N4CCCCC4)N

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)C3=C(C=CC(=C3)N4CCCCC4)N

InChI

InChI=1S/C20H22N4O/c1-14-16-7-3-4-8-17(16)20(25)24(22-14)19-13-15(9-10-18(19)21)23-11-5-2-6-12-23/h3-4,7-10,13H,2,5-6,11-12,21H2,1H3