2-[(3aR,7aS)-7a-(cyanomethyl)-2,3,4,7-tetrahydro-1H-inden-3a-yl]ethanenitrile

Systemtic Name: 2-[(3aR,7aS)-7a-(cyanomethyl)-2,3,4,7-tetrahydro-1H-inden-3a-yl]ethanenitrile Openeye Name: 2-[(3aR,7aS)-7a-(cyanomethyl)-2,3,4,7-tetrahydro-1H-inden-3a-yl]acetonitrile CAS Name: 2-[(3aR,7aS)-7a-(cyanomethyl)-2,3,4,7-tetrahydro-1H-inden-3a-yl]acetonitrile IUPAC Name: 2-[(3aR,7aS)-7a-(cyanomethyl)-2,3,4,7-tetrahydro-1H-inden-3a-yl]acetonitrile Traditional Name: 2-[(3aR,7aS)-7a-(cyanomethyl)-2,3,4,7-tetrahydro-1H-inden-3a-yl]acetonitrile Formula: C13H16N2 MolecularWeight: 200.27954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC=CCC2(C1)CC#N)CC#N

Isomeric SMILES

C1C[C@@]2(CC=CC[C@@]2(C1)CC#N)CC#N

InChI

InChI=1S/C13H16N2/c14-10-8-12-4-1-2-5-13(12,9-11-15)7-3-6-12/h1-2H,3-9H2/t12-,13+