4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-2-(phenylmethyl)phthalazin-1-one

Systemtic Name: 4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-2-(phenylmethyl)phthalazin-1-one Openeye Name: 2-benzyl-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]phthalazin-1-one CAS Name: 4-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-2-(phenylmethyl)-1-phthalazinone IUPAC Name: 2-benzyl-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]phthalazin-1-one Traditional Name: 2-benzyl-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]phthalazin-1-one Formula: C28H25N3O4 MolecularWeight: 467.5158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)O)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)O)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C28H25N3O4/c32-22-12-10-20(11-13-22)26(33)21-14-16-30(17-15-21)28(35)25-23-8-4-5-9-24(23)27(34)31(29-25)18-19-6-2-1-3-7-19/h1-13,21,32H,14-18H2