ethyl 2-[(5Z)-5-(1-cyano-2-methoxy-2-oxidanylidene-ethylidene)-2H-1,2,3,4-tetrazol-1-yl]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[(5Z)-5-(1-cyano-2-methoxy-2-oxidanylidene-ethylidene)-2H-1,2,3,4-tetrazol-1-yl]-3-phenyl-propanoate Openeye Name: ethyl 2-[(5Z)-5-(1-cyano-2-methoxy-2-oxo-ethylidene)-2H-tetrazol-1-yl]-3-phenyl-propanoate CAS Name: 2-[(5Z)-5-(1-cyano-2-methoxy-2-oxoethylidene)-2H-tetrazol-1-yl]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[(5Z)-5-(1-cyano-2-methoxy-2-oxoethylidene)-2H-tetrazol-1-yl]-3-phenylpropanoate Traditional Name: 2-[(5Z)-5-(1-cyano-2-keto-2-methoxy-ethylidene)-2H-tetrazol-1-yl]-3-phenyl-propionic acid ethyl ester Formula: C16H17N5O4 MolecularWeight: 343.33728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)N2C(=C(C#N)C(=O)OC)N=NN2

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)N2/C(=C(\C#N)/C(=O)OC)/N=NN2

InChI

InChI=1S/C16H17N5O4/c1-3-25-16(23)13(9-11-7-5-4-6-8-11)21-14(18-19-20-21)12(10-17)15(22)24-2/h4-8,13H,3,9H2,1-2H3,(H,18,20)/b14-12+