2-[4-[[(5-azanyl-1,2,3,4-tetrazol-1-yl)amino]methyl]phenoxy]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-[[(5-azanyl-1,2,3,4-tetrazol-1-yl)amino]methyl]phenoxy]-N-tert-butyl-ethanamide Openeye Name: 2-[4-[[(5-aminotetrazol-1-yl)amino]methyl]phenoxy]-N-tert-butyl-acetamide CAS Name: 2-[4-[[(5-amino-1-tetrazolyl)amino]methyl]phenoxy]-N-tert-butylacetamide IUPAC Name: 2-[4-[[(5-aminotetrazol-1-yl)amino]methyl]phenoxy]-N-tert-butylacetamide Traditional Name: 2-[4-[[(5-aminotetrazol-1-yl)amino]methyl]phenoxy]-N-tert-butyl-acetamide Formula: C14H21N7O2 MolecularWeight: 319.36224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=CC=C(C=C1)CNN2C(=NN=N2)N

Isomeric SMILES

CC(C)(C)NC(=O)COC1=CC=C(C=C1)CNN2C(=NN=N2)N

InChI

InChI=1S/C14H21N7O2/c1-14(2,3)17-12(22)9-23-11-6-4-10(5-7-11)8-16-21-13(15)18-19-20-21/h4-7,16H,8-9H2,1-3H3,(H,17,22)(H2,15,18,20)