3-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]propanenitrile

Systemtic Name: 3-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]propanenitrile Openeye Name: 3-[(5-chloro-2-hydroxy-phenyl)methylamino]propanenitrile CAS Name: 3-[(5-chloro-2-hydroxyphenyl)methylamino]propanenitrile IUPAC Name: 3-[(5-chloro-2-hydroxyphenyl)methylamino]propanenitrile Traditional Name: 3-[(5-chloro-2-hydroxy-benzyl)amino]propionitrile Formula: C10H11ClN2O MolecularWeight: 210.66014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)CNCCC#N)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)CNCCC#N)O

InChI

InChI=1S/C10H11ClN2O/c11-9-2-3-10(14)8(6-9)7-13-5-1-4-12/h2-3,6,13-14H,1,5,7H2