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

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-isopropyl-2-phenyl-valeronitrile Formula: C23H28N2O2 MolecularWeight: 364.48062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCNCC1COC2=CC=CC=C2O1)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCNCC1COC2=CC=CC=C2O1)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O2/c1-18(2)23(17-24,19-9-4-3-5-10-19)13-8-14-25-15-20-16-26-21-11-6-7-12-22(21)27-20/h3-7,9-12,18,20,25H,8,13-16H2,1-2H3