3-[3-(4-ethanoyl-1,4-diazepan-1-yl)-3-oxidanylidene-propyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[3-(4-ethanoyl-1,4-diazepan-1-yl)-3-oxidanylidene-propyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[3-(4-acetyl-1,4-diazepan-1-yl)-3-oxo-propyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[3-(4-acetyl-1,4-diazepan-1-yl)-3-oxopropyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[3-(4-acetyl-1,4-diazepan-1-yl)-3-oxopropyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[3-(4-acetyl-1,4-diazepan-1-yl)-3-keto-propyl]-1,2,3-benzotriazin-4-one Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(=O)N1CCCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H21N5O3/c1-13(23)20-8-4-9-21(12-11-20)16(24)7-10-22-17(25)14-5-2-3-6-15(14)18-19-22/h2-3,5-6H,4,7-12H2,1H3