methyl 2-azanyl-3-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]propanoate

Systemtic Name: methyl 2-azanyl-3-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]propanoate Openeye Name: methyl 2-amino-3-[3-(2H-tetrazol-5-yl)phenyl]propanoate CAS Name: 2-amino-3-[3-(2H-tetrazol-5-yl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[3-(2H-tetrazol-5-yl)phenyl]propanoate Traditional Name: 2-amino-3-[3-(2H-tetrazol-5-yl)phenyl]propionic acid methyl ester Formula: C11H13N5O2 MolecularWeight: 247.25322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC(=C1)C2=NNN=N2)N

Isomeric SMILES

COC(=O)C(CC1=CC=CC(=C1)C2=NNN=N2)N

InChI

InChI=1S/C11H13N5O2/c1-18-11(17)9(12)6-7-3-2-4-8(5-7)10-13-15-16-14-10/h2-5,9H,6,12H2,1H3,(H,13,14,15,16)