3-[(3-chloranyl-4-methoxy-phenyl)methyl-(oxolan-2-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl-(oxolan-2-ylmethyl)amino]propanenitrile Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]propanenitrile CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl-(2-oxolanylmethyl)amino]propanenitrile IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl-(oxolan-2-ylmethyl)amino]propanenitrile Traditional Name: 3-[(3-chloro-4-methoxy-benzyl)-(tetrahydrofurfuryl)amino]propionitrile Formula: C16H21ClN2O2 MolecularWeight: 308.80314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CCC#N)CC2CCCO2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CCC#N)CC2CCCO2)Cl

InChI

InChI=1S/C16H21ClN2O2/c1-20-16-6-5-13(10-15(16)17)11-19(8-3-7-18)12-14-4-2-9-21-14/h5-6,10,14H,2-4,8-9,11-12H2,1H3