3-(3,4-dihydro-1H-isochromen-1-yl)propanenitrile

Systemtic Name: 3-(3,4-dihydro-1H-isochromen-1-yl)propanenitrile Openeye Name: 3-isochroman-1-ylpropanenitrile CAS Name: 3-(3,4-dihydro-1H-2-benzopyran-1-yl)propanenitrile IUPAC Name: 3-(3,4-dihydro-1H-isochromen-1-yl)propanenitrile Traditional Name: 3-isochroman-1-ylpropionitrile Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=CC=CC=C21)CCC#N

Isomeric SMILES

C1COC(C2=CC=CC=C21)CCC#N

InChI

InChI=1S/C12H13NO/c13-8-3-6-12-11-5-2-1-4-10(11)7-9-14-12/h1-2,4-5,12H,3,6-7,9H2