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

Systemtic Name: 1-(azocan-1-yl)-2-[5-(4-ethylphenyl)-1,2,3,4-tetrazol-2-yl]ethanone Openeye Name: 1-(azocan-1-yl)-2-[5-(4-ethylphenyl)tetrazol-2-yl]ethanone CAS Name: 1-(1-azocanyl)-2-[5-(4-ethylphenyl)-2-tetrazolyl]ethanone IUPAC Name: 1-(azocan-1-yl)-2-[5-(4-ethylphenyl)tetrazol-2-yl]ethanone Traditional Name: 1-(azocan-1-yl)-2-[5-(4-ethylphenyl)tetrazol-2-yl]ethanone Formula: C18H25N5O MolecularWeight: 327.424

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)N3CCCCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)N3CCCCCCC3

InChI

InChI=1S/C18H25N5O/c1-2-15-8-10-16(11-9-15)18-19-21-23(20-18)14-17(24)22-12-6-4-3-5-7-13-22/h8-11H,2-7,12-14H2,1H3