azepan-1-yl-[4-(benzotriazol-1-ylmethyl)phenyl]methanone

Systemtic Name: azepan-1-yl-[4-(benzotriazol-1-ylmethyl)phenyl]methanone Openeye Name: azepan-1-yl-[4-(benzotriazol-1-ylmethyl)phenyl]methanone CAS Name: 1-azepanyl-[4-(1-benzotriazolylmethyl)phenyl]methanone IUPAC Name: azepan-1-yl-[4-(benzotriazol-1-ylmethyl)phenyl]methanone Traditional Name: azepan-1-yl-[4-(benzotriazol-1-ylmethyl)phenyl]methanone Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H22N4O/c25-20(23-13-5-1-2-6-14-23)17-11-9-16(10-12-17)15-24-19-8-4-3-7-18(19)21-22-24/h3-4,7-12H,1-2,5-6,13-15H2