1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanone

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanone Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-phenyltetrazol-2-yl)ethanone CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-phenyl-2-tetrazolyl)ethanone IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-phenyltetrazol-2-yl)ethanone Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-phenyltetrazol-2-yl)ethanone Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CN3N=C(N=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CN3N=C(N=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C20H21N5O3/c1-27-17-10-15-8-9-24(12-16(15)11-18(17)28-2)19(26)13-25-22-20(21-23-25)14-6-4-3-5-7-14/h3-7,10-11H,8-9,12-13H2,1-2H3