5,6,7-trimethoxyisoquinoline-1-carbonitrile

Systemtic Name: 5,6,7-trimethoxyisoquinoline-1-carbonitrile Openeye Name: 5,6,7-trimethoxyisoquinoline-1-carbonitrile CAS Name: 5,6,7-trimethoxy-1-isoquinolinecarbonitrile IUPAC Name: 5,6,7-trimethoxyisoquinoline-1-carbonitrile Traditional Name: 5,6,7-trimethoxyisoquinoline-1-carbonitrile Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C=CN=C(C2=C1)C#N)OC)OC

Isomeric SMILES

COC1=C(C(=C2C=CN=C(C2=C1)C#N)OC)OC

InChI

InChI=1S/C13H12N2O3/c1-16-11-6-9-8(4-5-15-10(9)7-14)12(17-2)13(11)18-3/h4-6H,1-3H3