5-[2-(1,3-benzodioxol-5-yloxy)ethyl-methyl-amino]-2-cyclopropyl-2-phenyl-pentanenitrile

Systemtic Name: 5-[2-(1,3-benzodioxol-5-yloxy)ethyl-methyl-amino]-2-cyclopropyl-2-phenyl-pentanenitrile Openeye Name: 5-[2-(1,3-benzodioxol-5-yloxy)ethyl-methyl-amino]-2-cyclopropyl-2-phenyl-pentanenitrile CAS Name: 5-[2-(1,3-benzodioxol-5-yloxy)ethyl-methylamino]-2-cyclopropyl-2-phenylpentanenitrile IUPAC Name: 5-[2-(1,3-benzodioxol-5-yloxy)ethyl-methylamino]-2-cyclopropyl-2-phenylpentanenitrile Traditional Name: 5-[2-(1,3-benzodioxol-5-yloxy)ethyl-methyl-amino]-2-cyclopropyl-2-phenyl-valeronitrile Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(C#N)(C1CC1)C2=CC=CC=C2)CCOC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN(CCCC(C#N)(C1CC1)C2=CC=CC=C2)CCOC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H28N2O3/c1-26(14-15-27-21-10-11-22-23(16-21)29-18-28-22)13-5-12-24(17-25,20-8-9-20)19-6-3-2-4-7-19/h2-4,6-7,10-11,16,20H,5,8-9,12-15,18H2,1H3