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

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl-(pyridin-3-ylmethyl)amino]propanenitrile Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl-(3-pyridylmethyl)amino]propanenitrile CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl-(3-pyridinylmethyl)amino]propanenitrile IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl-(pyridin-3-ylmethyl)amino]propanenitrile Traditional Name: 3-[(3-chloro-4-methoxy-benzyl)-(3-pyridylmethyl)amino]propionitrile Formula: C17H18ClN3O MolecularWeight: 315.79732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CCC#N)CC2=CN=CC=C2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CCC#N)CC2=CN=CC=C2)Cl

InChI

InChI=1S/C17H18ClN3O/c1-22-17-6-5-14(10-16(17)18)12-21(9-3-7-19)13-15-4-2-8-20-11-15/h2,4-6,8,10-11H,3,9,12-13H2,1H3