1-ethoxy-3-methyl-isoquinoline-4-carbonitrile

Systemtic Name: 1-ethoxy-3-methyl-isoquinoline-4-carbonitrile Openeye Name: 1-ethoxy-3-methyl-isoquinoline-4-carbonitrile CAS Name: 1-ethoxy-3-methyl-4-isoquinolinecarbonitrile IUPAC Name: 1-ethoxy-3-methylisoquinoline-4-carbonitrile Traditional Name: 1-ethoxy-3-methyl-isoquinoline-4-carbonitrile Formula: C13H12N2O MolecularWeight: 212.24718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=C(C2=CC=CC=C21)C#N)C

Isomeric SMILES

CCOC1=NC(=C(C2=CC=CC=C21)C#N)C

InChI

InChI=1S/C13H12N2O/c1-3-16-13-11-7-5-4-6-10(11)12(8-14)9(2)15-13/h4-7H,3H2,1-2H3