3-chloranyl-4-[(1-propyl-1,2,3,4-tetrazol-5-yl)methoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[(1-propyl-1,2,3,4-tetrazol-5-yl)methoxy]benzenecarbonitrile Openeye Name: 3-chloro-4-[(1-propyltetrazol-5-yl)methoxy]benzonitrile CAS Name: 3-chloro-4-[(1-propyl-5-tetrazolyl)methoxy]benzonitrile IUPAC Name: 3-chloro-4-[(1-propyltetrazol-5-yl)methoxy]benzonitrile Traditional Name: 3-chloro-4-[(1-propyltetrazol-5-yl)methoxy]benzonitrile Formula: C12H12ClN5O MolecularWeight: 277.70958

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

CCCN1C(=NN=N1)COC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C12H12ClN5O/c1-2-5-18-12(15-16-17-18)8-19-11-4-3-9(7-14)6-10(11)13/h3-4,6H,2,5,8H2,1H3