5-chloranyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-chloranyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-propan-2-yl-pentanenitrile Openeye Name: 5-chloro-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-isopropyl-pentanenitrile CAS Name: 5-chloro-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-propan-2-ylpentanenitrile IUPAC Name: 5-chloro-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-propan-2-ylpentanenitrile Traditional Name: 5-chloro-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-isopropyl-valeronitrile Formula: C16H20ClNO2 MolecularWeight: 293.7885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCCl)(C#N)C1COC2=CC=CC=C2O1

Isomeric SMILES

CC(C)C(CCCCl)(C#N)C1COC2=CC=CC=C2O1

InChI

InChI=1S/C16H20ClNO2/c1-12(2)16(11-18,8-5-9-17)15-10-19-13-6-3-4-7-14(13)20-15/h3-4,6-7,12,15H,5,8-10H2,1-2H3