N1-[(3-chloranyl-4,5-diethoxy-phenyl)methyl]-1,2,3,4-tetrazole-1,5-diamine

Systemtic Name: N1-[(3-chloranyl-4,5-diethoxy-phenyl)methyl]-1,2,3,4-tetrazole-1,5-diamine Openeye Name: N1-[(3-chloro-4,5-diethoxy-phenyl)methyl]tetrazole-1,5-diamine CAS Name: N1-[(3-chloro-4,5-diethoxyphenyl)methyl]tetrazole-1,5-diamine IUPAC Name: 1-N-[(3-chloro-4,5-diethoxyphenyl)methyl]tetrazole-1,5-diamine Traditional Name: (5-aminotetrazol-1-yl)-(3-chloro-4,5-diethoxy-benzyl)amine Formula: C12H17ClN6O2 MolecularWeight: 312.75538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNN2C(=NN=N2)N)Cl)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNN2C(=NN=N2)N)Cl)OCC

InChI

InChI=1S/C12H17ClN6O2/c1-3-20-10-6-8(5-9(13)11(10)21-4-2)7-15-19-12(14)16-17-18-19/h5-6,15H,3-4,7H2,1-2H3,(H2,14,16,18)