3-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-(furan-2-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-(furan-2-ylmethyl)amino]propanenitrile Openeye Name: 3-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]-(2-furylmethyl)amino]propanenitrile CAS Name: 3-[[2-(3-chlorophenyl)-2-hydroxyethyl]-(2-furanylmethyl)amino]propanenitrile IUPAC Name: 3-[[2-(3-chlorophenyl)-2-hydroxyethyl]-(furan-2-ylmethyl)amino]propanenitrile Traditional Name: 3-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]-(2-furfuryl)amino]propionitrile Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(CN(CCC#N)CC2=CC=CO2)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(CN(CCC#N)CC2=CC=CO2)O

InChI

InChI=1S/C16H17ClN2O2/c17-14-5-1-4-13(10-14)16(20)12-19(8-3-7-18)11-15-6-2-9-21-15/h1-2,4-6,9-10,16,20H,3,8,11-12H2