(4-ethoxy-3-methoxy-phenyl)methyl-methyl-[(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)methyl]azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)methyl]azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[[5-oxo-4-(2-thienyl)tetrazol-1-yl]methyl]ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[(5-oxo-4-thiophen-2-yl-1-tetrazolyl)methyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[(5-oxo-4-thiophen-2-yltetrazol-1-yl)methyl]azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-[[5-keto-4-(2-thienyl)tetrazol-1-yl]methyl]-methyl-ammonium Formula: C17H22N5O3S+ MolecularWeight: 376.45328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](C)CN2C(=O)N(N=N2)C3=CC=CS3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](C)CN2C(=O)N(N=N2)C3=CC=CS3)OC

InChI

InChI=1S/C17H21N5O3S/c1-4-25-14-8-7-13(10-15(14)24-3)11-20(2)12-21-17(23)22(19-18-21)16-6-5-9-26-16/h5-10H,4,11-12H2,1-3H3/p+1