4-oxidanylidene-3-[2-oxidanylidene-2-[4-[(R)-oxidanyl(phenyl)methyl]piperidin-1-yl]ethyl]phthalazin-1-olate

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-[4-[(R)-oxidanyl(phenyl)methyl]piperidin-1-yl]ethyl]phthalazin-1-olate Openeye Name: 3-[2-[4-[(R)-hydroxy(phenyl)methyl]-1-piperidyl]-2-oxo-ethyl]-4-oxo-phthalazin-1-olate CAS Name: 3-[2-[4-[(R)-hydroxy(phenyl)methyl]-1-piperidinyl]-2-oxoethyl]-4-oxo-1-phthalazinolate IUPAC Name: 3-[2-[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]-2-oxoethyl]-4-oxophthalazin-1-olate Traditional Name: 3-[2-[4-[(R)-hydroxy(phenyl)methyl]piperidino]-2-keto-ethyl]-4-keto-phthalazin-1-olate Formula: C22H22N3O4- MolecularWeight: 392.42778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC=CC=C2)O)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

C1CN(CCC1[C@H](C2=CC=CC=C2)O)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C22H23N3O4/c26-19(14-25-22(29)18-9-5-4-8-17(18)21(28)23-25)24-12-10-16(11-13-24)20(27)15-6-2-1-3-7-15/h1-9,16,20,27H,10-14H2,(H,23,28)/p-1/t20-/m0/s1