1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-phenyl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-phenyl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-phenyl-tetrazol-5-one CAS Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-phenyl-5-tetrazolone IUPAC Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-phenyltetrazol-5-one Traditional Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-phenyl-tetrazol-5-one Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CN3C(=O)N(N=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CN3C(=O)N(N=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C19H21N5O3/c1-26-17-10-14-8-9-22(12-15(14)11-18(17)27-2)13-23-19(25)24(21-20-23)16-6-4-3-5-7-16/h3-7,10-11H,8-9,12-13H2,1-2H3