3-[2-cyanoethyl-[(5-methyl-2-oxidanyl-phenyl)methyl]amino]propanenitrile

Systemtic Name: 3-[2-cyanoethyl-[(5-methyl-2-oxidanyl-phenyl)methyl]amino]propanenitrile Openeye Name: 3-[2-cyanoethyl-[(2-hydroxy-5-methyl-phenyl)methyl]amino]propanenitrile CAS Name: 3-[2-cyanoethyl-[(2-hydroxy-5-methylphenyl)methyl]amino]propanenitrile IUPAC Name: 3-[2-cyanoethyl-[(2-hydroxy-5-methylphenyl)methyl]amino]propanenitrile Traditional Name: 3-[2-cyanoethyl-(2-hydroxy-5-methyl-benzyl)amino]propionitrile Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)CN(CCC#N)CCC#N

Isomeric SMILES

CC1=CC(=C(C=C1)O)CN(CCC#N)CCC#N

InChI

InChI=1S/C14H17N3O/c1-12-4-5-14(18)13(10-12)11-17(8-2-6-15)9-3-7-16/h4-5,10,18H,2-3,8-9,11H2,1H3