4-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]butanenitrile

Systemtic Name: 4-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]butanenitrile Openeye Name: 4-(4-chloro-2,5-dimethoxy-anilino)butanenitrile CAS Name: 4-(4-chloro-2,5-dimethoxyanilino)butanenitrile IUPAC Name: 4-(4-chloro-2,5-dimethoxyanilino)butanenitrile Traditional Name: 4-(4-chloro-2,5-dimethoxy-anilino)butyronitrile Formula: C12H15ClN2O2 MolecularWeight: 254.7127

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NCCCC#N)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NCCCC#N)OC)Cl

InChI

InChI=1S/C12H15ClN2O2/c1-16-11-8-10(15-6-4-3-5-14)12(17-2)7-9(11)13/h7-8,15H,3-4,6H2,1-2H3