1-(azepan-1-yl)-2-(benzotriazol-1-yl)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(benzotriazol-1-yl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(benzotriazol-1-yl)ethanone CAS Name: 1-(1-azepanyl)-2-(1-benzotriazolyl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(benzotriazol-1-yl)ethanone Traditional Name: 1-(azepan-1-yl)-2-(benzotriazol-1-yl)ethanone Formula: C14H18N4O MolecularWeight: 258.31892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H18N4O/c19-14(17-9-5-1-2-6-10-17)11-18-13-8-4-3-7-12(13)15-16-18/h3-4,7-8H,1-2,5-6,9-11H2