azepan-1-yl-[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methanone

Systemtic Name: azepan-1-yl-[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methanone Openeye Name: azepan-1-yl-[4-(2H-tetrazol-5-yl)phenyl]methanone CAS Name: 1-azepanyl-[4-(2H-tetrazol-5-yl)phenyl]methanone IUPAC Name: azepan-1-yl-[4-(2H-tetrazol-5-yl)phenyl]methanone Traditional Name: azepan-1-yl-[4-(2H-tetrazol-5-yl)phenyl]methanone Formula: C14H17N5O MolecularWeight: 271.31768

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)C3=NNN=N3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)C3=NNN=N3

InChI

InChI=1S/C14H17N5O/c20-14(19-9-3-1-2-4-10-19)12-7-5-11(6-8-12)13-15-17-18-16-13/h5-8H,1-4,9-10H2,(H,15,16,17,18)