3-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[4-(azepane-1-carbonyl)-1-piperidyl]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[4-(azepane-1-carbonyl)piperidin-1-yl]methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[4-(azepane-1-carbonyl)piperidino]methyl]-1,2,3-benzotriazin-4-one Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H27N5O2/c26-19(24-11-5-1-2-6-12-24)16-9-13-23(14-10-16)15-25-20(27)17-7-3-4-8-18(17)21-22-25/h3-4,7-8,16H,1-2,5-6,9-15H2