2-[5-(azepan-1-ylmethyl)-1,2,3,4-tetrazol-1-yl]-N-methyl-N-(2-oxidanyl-2-phenyl-ethyl)ethanamide

Systemtic Name: 2-[5-(azepan-1-ylmethyl)-1,2,3,4-tetrazol-1-yl]-N-methyl-N-(2-oxidanyl-2-phenyl-ethyl)ethanamide Openeye Name: 2-[5-(azepan-1-ylmethyl)tetrazol-1-yl]-N-(2-hydroxy-2-phenyl-ethyl)-N-methyl-acetamide CAS Name: 2-[5-(1-azepanylmethyl)-1-tetrazolyl]-N-(2-hydroxy-2-phenylethyl)-N-methylacetamide IUPAC Name: 2-[5-(azepan-1-ylmethyl)tetrazol-1-yl]-N-(2-hydroxy-2-phenylethyl)-N-methylacetamide Traditional Name: 2-[5-(azepan-1-ylmethyl)tetrazol-1-yl]-N-(2-hydroxy-2-phenyl-ethyl)-N-methyl-acetamide Formula: C19H28N6O2 MolecularWeight: 372.46462

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(C1=CC=CC=C1)O)C(=O)CN2C(=NN=N2)CN3CCCCCC3

Isomeric SMILES

CN(CC(C1=CC=CC=C1)O)C(=O)CN2C(=NN=N2)CN3CCCCCC3

InChI

InChI=1S/C19H28N6O2/c1-23(13-17(26)16-9-5-4-6-10-16)19(27)15-25-18(20-21-22-25)14-24-11-7-2-3-8-12-24/h4-6,9-10,17,26H,2-3,7-8,11-15H2,1H3