4-oxidanylidene-3-(phenylmethyl)-N-[(3-piperidin-1-ylcarbonylphenyl)methyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[(3-piperidin-1-ylcarbonylphenyl)methyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[[3-(piperidine-1-carbonyl)phenyl]methyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[[3-[oxo(1-piperidinyl)methyl]phenyl]methyl]-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[[3-(piperidine-1-carbonyl)phenyl]methyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[3-(piperidine-1-carbonyl)benzyl]phthalazine-1-carboxamide Formula: C29H28N4O3 MolecularWeight: 480.55762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=CC=C2)CNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=CC=C2)CNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N4O3/c34-27(30-19-22-12-9-13-23(18-22)28(35)32-16-7-2-8-17-32)26-24-14-5-6-15-25(24)29(36)33(31-26)20-21-10-3-1-4-11-21/h1,3-6,9-15,18H,2,7-8,16-17,19-20H2,(H,30,34)