3-[(2S)-1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(2S)-1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(1S)-2-(4-benzyl-1-piperidyl)-1-methyl-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[(2S)-1-oxo-1-[4-(phenylmethyl)-1-piperidinyl]propan-2-yl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(2S)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[(1S)-2-(4-benzylpiperidino)-2-keto-1-methyl-ethyl]-1,2,3-benzotriazin-4-one Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C[C@@H](C(=O)N1CCC(CC1)CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H24N4O2/c1-16(26-22(28)19-9-5-6-10-20(19)23-24-26)21(27)25-13-11-18(12-14-25)15-17-7-3-2-4-8-17/h2-10,16,18H,11-15H2,1H3/t16-/m0/s1