2-methyl-3-[5-oxidanylidene-6-(phenylmethylidene)-2,3,4,7,8,8a-hexahydro-1H-naphthalen-4a-yl]propanenitrile

Systemtic Name: 2-methyl-3-[5-oxidanylidene-6-(phenylmethylidene)-2,3,4,7,8,8a-hexahydro-1H-naphthalen-4a-yl]propanenitrile Openeye Name: 3-(3-benzylidene-4-oxo-decalin-4a-yl)-2-methyl-propanenitrile CAS Name: 2-methyl-3-[5-oxo-6-(phenylmethylene)-2,3,4,7,8,8a-hexahydro-1H-naphthalen-4a-yl]propanenitrile IUPAC Name: 3-(6-benzylidene-5-oxo-2,3,4,7,8,8a-hexahydro-1H-naphthalen-4a-yl)-2-methylpropanenitrile Traditional Name: 3-(3-benzal-4-keto-decalin-4a-yl)-2-methyl-propionitrile Formula: C21H25NO MolecularWeight: 307.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC12CCCCC1CCC(=CC3=CC=CC=C3)C2=O)C#N

Isomeric SMILES

CC(CC12CCCCC1CCC(=CC3=CC=CC=C3)C2=O)C#N

InChI

InChI=1S/C21H25NO/c1-16(15-22)14-21-12-6-5-9-19(21)11-10-18(20(21)23)13-17-7-3-2-4-8-17/h2-4,7-8,13,16,19H,5-6,9-12,14H2,1H3