4-[[(2S,4S)-2-(phenylmethyl)piperidin-4-yl]amino]-2H-phthalazin-1-one

Systemtic Name: 4-[[(2S,4S)-2-(phenylmethyl)piperidin-4-yl]amino]-2H-phthalazin-1-one Openeye Name: 4-[[(2S,4S)-2-benzyl-4-piperidyl]amino]-2H-phthalazin-1-one CAS Name: 4-[[(2S,4S)-2-(phenylmethyl)-4-piperidinyl]amino]-2H-phthalazin-1-one IUPAC Name: 4-[[(2S,4S)-2-benzylpiperidin-4-yl]amino]-2H-phthalazin-1-one Traditional Name: 4-[[(2S,4S)-2-benzyl-4-piperidyl]amino]-2H-phthalazin-1-one Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(CC1NC2=NNC(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1CN[C@H](C[C@H]1NC2=NNC(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O/c25-20-18-9-5-4-8-17(18)19(23-24-20)22-15-10-11-21-16(13-15)12-14-6-2-1-3-7-14/h1-9,15-16,21H,10-13H2,(H,22,23)(H,24,25)/t15-,16-/m0/s1