4-oxidanylidene-N-[4-(4-oxidanylpiperidin-1-yl)phenyl]-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[4-(4-oxidanylpiperidin-1-yl)phenyl]-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[4-(4-hydroxy-1-piperidyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(4-hydroxy-1-piperidinyl)phenyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[4-(4-hydroxypiperidin-1-yl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[4-(4-hydroxypiperidino)phenyl]-4-keto-phthalazine-1-carboxamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1O)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C27H26N4O3/c32-22-14-16-30(17-15-22)21-12-10-20(11-13-21)28-26(33)25-23-8-4-5-9-24(23)27(34)31(29-25)18-19-6-2-1-3-7-19/h1-13,22,32H,14-18H2,(H,28,33)