2-[5-[(5-azanyl-1,2,3,4-tetrazol-1-yl)iminomethyl]-3-chloranyl-2-methoxy-phenoxy]ethanenitrile

Systemtic Name: 2-[5-[(5-azanyl-1,2,3,4-tetrazol-1-yl)iminomethyl]-3-chloranyl-2-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[5-[(5-aminotetrazol-1-yl)iminomethyl]-3-chloro-2-methoxy-phenoxy]acetonitrile CAS Name: 2-[5-[(5-amino-1-tetrazolyl)iminomethyl]-3-chloro-2-methoxyphenoxy]acetonitrile IUPAC Name: 2-[5-[(5-aminotetrazol-1-yl)iminomethyl]-3-chloro-2-methoxyphenoxy]acetonitrile Traditional Name: 2-[5-[(5-aminotetrazol-1-yl)iminomethyl]-3-chloro-2-methoxy-phenoxy]acetonitrile Formula: C11H10ClN7O2 MolecularWeight: 307.6958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C=NN2C(=NN=N2)N)OCC#N

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C=NN2C(=NN=N2)N)OCC#N

InChI

InChI=1S/C11H10ClN7O2/c1-20-10-8(12)4-7(5-9(10)21-3-2-13)6-15-19-11(14)16-17-18-19/h4-6H,3H2,1H3,(H2,14,16,18)