2-[(3-methyl-4-oxidanyl-phenyl)amino]heptanenitrile hydrochloride

Systemtic Name: 2-[(3-methyl-4-oxidanyl-phenyl)amino]heptanenitrile hydrochloride Openeye Name: 2-(4-hydroxy-3-methyl-anilino)heptanenitrile hydrochloride CAS Name: 2-(4-hydroxy-3-methylanilino)heptanenitrile hydrochloride IUPAC Name: 2-(4-hydroxy-3-methylanilino)heptanenitrile hydrochloride Traditional Name: 2-(4-hydroxy-3-methyl-anilino)enanthonitrile hydrochloride Formula: C14H21ClN2O MolecularWeight: 268.78234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#N)NC1=CC(=C(C=C1)O)C.Cl

Isomeric SMILES

CCCCCC(C#N)NC1=CC(=C(C=C1)O)C.Cl

InChI

InChI=1S/C14H20N2O.ClH/c1-3-4-5-6-13(10-15)16-12-7-8-14(17)11(2)9-12;/h7-9,13,16-17H,3-6H2,1-2H3;1H