ethyl (E)-3-phenyl-2-(2H-1,2,3,4-tetrazol-5-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-phenyl-2-(2H-1,2,3,4-tetrazol-5-yl)prop-2-enoate Openeye Name: ethyl (E)-3-phenyl-2-(2H-tetrazol-5-yl)prop-2-enoate CAS Name: (E)-3-phenyl-2-(2H-tetrazol-5-yl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-phenyl-2-(2H-tetrazol-5-yl)prop-2-enoate Traditional Name: (E)-3-phenyl-2-(2H-tetrazol-5-yl)acrylic acid ethyl ester Formula: C12H12N4O2 MolecularWeight: 244.24928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=CC=C1)C2=NNN=N2

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=CC=C1)/C2=NNN=N2

InChI

InChI=1S/C12H12N4O2/c1-2-18-12(17)10(11-13-15-16-14-11)8-9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,13,14,15,16)/b10-8+