N-[5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-2-piperidin-1-yl-phenyl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-2-piperidin-1-yl-phenyl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[5-(3-methyl-4-oxo-phthalazin-1-yl)-2-(1-piperidyl)phenyl]-2-(3-methylphenoxy)acetamide CAS Name: N-[5-(3-methyl-4-oxo-1-phthalazinyl)-2-(1-piperidinyl)phenyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[5-(3-methyl-4-oxophthalazin-1-yl)-2-piperidin-1-ylphenyl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[5-(4-keto-3-methyl-phthalazin-1-yl)-2-piperidino-phenyl]-2-(3-methylphenoxy)acetamide Formula: C29H30N4O3 MolecularWeight: 482.5735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=C(C=CC(=C2)C3=NN(C(=O)C4=CC=CC=C43)C)N5CCCCC5

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=C(C=CC(=C2)C3=NN(C(=O)C4=CC=CC=C43)C)N5CCCCC5

InChI

InChI=1S/C29H30N4O3/c1-20-9-8-10-22(17-20)36-19-27(34)30-25-18-21(13-14-26(25)33-15-6-3-7-16-33)28-23-11-4-5-12-24(23)29(35)32(2)31-28/h4-5,8-14,17-18H,3,6-7,15-16,19H2,1-2H3,(H,30,34)