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

Systemtic Name: (3,4-dimethoxyphenyl)methyl-methyl-[(5-oxidanylidene-4-phenyl-1,2,3,4-tetrazol-1-yl)methyl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-methyl-[(5-oxo-4-phenyl-tetrazol-1-yl)methyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-methyl-[(5-oxo-4-phenyl-1-tetrazolyl)methyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-methyl-[(5-oxo-4-phenyltetrazol-1-yl)methyl]azanium Traditional Name: (5-keto-4-phenyl-tetrazol-1-yl)methyl-methyl-veratryl-ammonium Formula: C18H22N5O3+ MolecularWeight: 356.39898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)OC)OC)CN2C(=O)N(N=N2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)OC)OC)CN2C(=O)N(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H21N5O3/c1-21(12-14-9-10-16(25-2)17(11-14)26-3)13-22-18(24)23(20-19-22)15-7-5-4-6-8-15/h4-11H,12-13H2,1-3H3/p+1