(1S)-6,7-dimethoxy-3-methyl-1H-isochromene-1-carbonitrile

Systemtic Name: (1S)-6,7-dimethoxy-3-methyl-1H-isochromene-1-carbonitrile Openeye Name: (1S)-6,7-dimethoxy-3-methyl-1H-isochromene-1-carbonitrile CAS Name: (1S)-6,7-dimethoxy-3-methyl-1H-2-benzopyran-1-carbonitrile IUPAC Name: (1S)-6,7-dimethoxy-3-methyl-1H-isochromene-1-carbonitrile Traditional Name: (1S)-6,7-dimethoxy-3-methyl-1H-isochromene-1-carbonitrile Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C=C2C(O1)C#N)OC)OC

Isomeric SMILES

CC1=CC2=CC(=C(C=C2[C@H](O1)C#N)OC)OC

InChI

InChI=1S/C13H13NO3/c1-8-4-9-5-11(15-2)12(16-3)6-10(9)13(7-14)17-8/h4-6,13H,1-3H3/t13-/m1/s1