1-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-4-phenyl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-4-phenyl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]-4-phenyl-tetrazol-5-one CAS Name: 1-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl]-4-phenyl-5-tetrazolone IUPAC Name: 1-[(6,7-dimethyl-2-oxochromen-4-yl)methyl]-4-phenyltetrazol-5-one Traditional Name: 1-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]-4-phenyl-tetrazol-5-one Formula: C19H16N4O3 MolecularWeight: 348.35534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3C(=O)N(N=N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3C(=O)N(N=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C19H16N4O3/c1-12-8-16-14(10-18(24)26-17(16)9-13(12)2)11-22-19(25)23(21-20-22)15-6-4-3-5-7-15/h3-10H,11H2,1-2H3