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

Systemtic Name: 3-[2-[4-(1H-indol-3-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-[4-(1H-indol-3-yl)-1-piperidyl]-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-[4-(1H-indol-3-yl)-1-piperidinyl]-2-oxoethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-[4-(1H-indol-3-yl)piperidin-1-yl]-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-[4-(1H-indol-3-yl)piperidino]-2-keto-ethyl]-1,2,3-benzotriazin-4-one Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CNC3=CC=CC=C32)C(=O)CN4C(=O)C5=CC=CC=C5N=N4

Isomeric SMILES

C1CN(CCC1C2=CNC3=CC=CC=C32)C(=O)CN4C(=O)C5=CC=CC=C5N=N4

InChI

InChI=1S/C22H21N5O2/c28-21(14-27-22(29)17-6-2-4-8-20(17)24-25-27)26-11-9-15(10-12-26)18-13-23-19-7-3-1-5-16(18)19/h1-8,13,15,23H,9-12,14H2