4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-triazole-3-carbonitrile Formula: C15H17N5O2 MolecularWeight: 299.32778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CN3C=NN=C3C#N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CN3C=NN=C3C#N)OC

InChI

InChI=1S/C15H17N5O2/c1-21-13-5-11-3-4-19(8-12(11)6-14(13)22-2)10-20-9-17-18-15(20)7-16/h5-6,9H,3-4,8,10H2,1-2H3