3-(4-oxidanylidene-2-propan-2-yl-2,3-dihydrochromen-3-yl)-3-phenyl-propanenitrile

Systemtic Name: 3-(4-oxidanylidene-2-propan-2-yl-2,3-dihydrochromen-3-yl)-3-phenyl-propanenitrile Openeye Name: 3-(2-isopropyl-4-oxo-chroman-3-yl)-3-phenyl-propanenitrile CAS Name: 3-(4-oxo-2-propan-2-yl-3,4-dihydro-2H-1-benzopyran-3-yl)-3-phenylpropanenitrile IUPAC Name: 3-(4-oxo-2-propan-2-yl-2,3-dihydrochromen-3-yl)-3-phenylpropanenitrile Traditional Name: 3-(2-isopropyl-4-keto-chroman-3-yl)-3-phenyl-propionitrile Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(C(=O)C2=CC=CC=C2O1)C(CC#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1C(C(=O)C2=CC=CC=C2O1)C(CC#N)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO2/c1-14(2)21-19(16(12-13-22)15-8-4-3-5-9-15)20(23)17-10-6-7-11-18(17)24-21/h3-11,14,16,19,21H,12H2,1-2H3