1-(azepan-1-yl)-2-[5-(4-ethylphenyl)-1,2,3,4-tetrazol-2-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[5-(4-ethylphenyl)-1,2,3,4-tetrazol-2-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[5-(4-ethylphenyl)tetrazol-2-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[5-(4-ethylphenyl)-2-tetrazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[5-(4-ethylphenyl)tetrazol-2-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[5-(4-ethylphenyl)tetrazol-2-yl]ethanone Formula: C17H23N5O MolecularWeight: 313.39742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)N3CCCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C17H23N5O/c1-2-14-7-9-15(10-8-14)17-18-20-22(19-17)13-16(23)21-11-5-3-4-6-12-21/h7-10H,2-6,11-13H2,1H3