3-[4-(azepan-1-yl)-4-oxidanylidene-butyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[4-(azepan-1-yl)-4-oxidanylidene-butyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[4-(azepan-1-yl)-4-oxo-butyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[4-(1-azepanyl)-4-oxobutyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[4-(azepan-1-yl)-4-oxobutyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[4-(azepan-1-yl)-4-keto-butyl]-1,2,3-benzotriazin-4-one Formula: C17H22N4O2 MolecularWeight: 314.38218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C1CCCN(CC1)C(=O)CCCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H22N4O2/c22-16(20-11-5-1-2-6-12-20)10-7-13-21-17(23)14-8-3-4-9-15(14)18-19-21/h3-4,8-9H,1-2,5-7,10-13H2