methyl 4-[5-(2-oxidanylidenechromen-7-yl)oxy-1,2,3,4-tetrazol-1-yl]benzoate

Systemtic Name: methyl 4-[5-(2-oxidanylidenechromen-7-yl)oxy-1,2,3,4-tetrazol-1-yl]benzoate Openeye Name: methyl 4-[5-(2-oxochromen-7-yl)oxytetrazol-1-yl]benzoate CAS Name: 4-[5-[(2-oxo-1-benzopyran-7-yl)oxy]-1-tetrazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(2-oxochromen-7-yl)oxytetrazol-1-yl]benzoate Traditional Name: 4-[5-(2-ketochromen-7-yl)oxytetrazol-1-yl]benzoic acid methyl ester Formula: C18H12N4O5 MolecularWeight: 364.31168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=NN=N2)OC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=NN=N2)OC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C18H12N4O5/c1-25-17(24)12-2-6-13(7-3-12)22-18(19-20-21-22)26-14-8-4-11-5-9-16(23)27-15(11)10-14/h2-10H,1H3