tert-butyl-[[3-ethoxy-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)oxy]phenyl]methyl]azanium

Systemtic Name: tert-butyl-[[3-ethoxy-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)oxy]phenyl]methyl]azanium Openeye Name: tert-butyl-[[3-ethoxy-4-(1-phenyltetrazol-5-yl)oxy-phenyl]methyl]ammonium CAS Name: tert-butyl-[[3-ethoxy-4-[(1-phenyl-5-tetrazolyl)oxy]phenyl]methyl]ammonium IUPAC Name: tert-butyl-[[3-ethoxy-4-(1-phenyltetrazol-5-yl)oxyphenyl]methyl]azanium Traditional Name: tert-butyl-[3-ethoxy-4-(1-phenyltetrazol-5-yl)oxy-benzyl]ammonium Formula: C20H26N5O2+ MolecularWeight: 368.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C(C)(C)C)OC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C(C)(C)C)OC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C20H25N5O2/c1-5-26-18-13-15(14-21-20(2,3)4)11-12-17(18)27-19-22-23-24-25(19)16-9-7-6-8-10-16/h6-13,21H,5,14H2,1-4H3/p+1