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

Systemtic Name: 1-(azepan-1-yl)-2-[5-(4-propoxyphenyl)-1,2,3,4-tetrazol-2-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[5-(4-propoxyphenyl)tetrazol-2-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[5-(4-propoxyphenyl)-2-tetrazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[5-(4-propoxyphenyl)tetrazol-2-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[5-(4-propoxyphenyl)tetrazol-2-yl]ethanone Formula: C18H25N5O2 MolecularWeight: 343.4234

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)N3CCCCCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C18H25N5O2/c1-2-13-25-16-9-7-15(8-10-16)18-19-21-23(20-18)14-17(24)22-11-5-3-4-6-12-22/h7-10H,2-6,11-14H2,1H3