1-[2-(4-phenyl-1,2,3-triazol-2-yl)ethyl]azepane

Systemtic Name: 1-[2-(4-phenyl-1,2,3-triazol-2-yl)ethyl]azepane Openeye Name: 1-[2-(4-phenyltriazol-2-yl)ethyl]azepane CAS Name: 1-[2-(4-phenyl-2-triazolyl)ethyl]azepane IUPAC Name: 1-[2-(4-phenyltriazol-2-yl)ethyl]azepane Traditional Name: 1-[2-(4-phenyltriazol-2-yl)ethyl]azepane Formula: C16H22N4 MolecularWeight: 270.37268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCN2N=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)CCN2N=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H22N4/c1-2-7-11-19(10-6-1)12-13-20-17-14-16(18-20)15-8-4-3-5-9-15/h3-5,8-9,14H,1-2,6-7,10-13H2