2-[(3S)-3-methyl-3,4-dihydroisoquinolin-1-yl]propanedinitrile

Systemtic Name: 2-[(3S)-3-methyl-3,4-dihydroisoquinolin-1-yl]propanedinitrile Openeye Name: 2-[(3S)-3-methyl-3,4-dihydroisoquinolin-1-yl]propanedinitrile CAS Name: 2-[(3S)-3-methyl-3,4-dihydroisoquinolin-1-yl]propanedinitrile IUPAC Name: 2-[(3S)-3-methyl-3,4-dihydroisoquinolin-1-yl]propanedinitrile Traditional Name: 2-[(3S)-3-methyl-3,4-dihydroisoquinolin-1-yl]malononitrile Formula: C13H11N3 MolecularWeight: 209.24654

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2C(=N1)C(C#N)C#N

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2C(=N1)C(C#N)C#N

InChI

InChI=1S/C13H11N3/c1-9-6-10-4-2-3-5-12(10)13(16-9)11(7-14)8-15/h2-5,9,11H,6H2,1H3/t9-/m0/s1