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

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-(4-benzylpiperidino)-2-keto-ethyl]-1,2,3-benzotriazin-4-one Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H22N4O2/c26-20(15-25-21(27)18-8-4-5-9-19(18)22-23-25)24-12-10-17(11-13-24)14-16-6-2-1-3-7-16/h1-9,17H,10-15H2