3-[(2,5-dimethoxyphenyl)amino]pentanenitrile

Systemtic Name: 3-[(2,5-dimethoxyphenyl)amino]pentanenitrile Openeye Name: 3-(2,5-dimethoxyanilino)pentanenitrile CAS Name: 3-(2,5-dimethoxyanilino)pentanenitrile IUPAC Name: 3-(2,5-dimethoxyanilino)pentanenitrile Traditional Name: 3-(2,5-dimethoxyanilino)valeronitrile Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)NC1=C(C=CC(=C1)OC)OC

Isomeric SMILES

CCC(CC#N)NC1=C(C=CC(=C1)OC)OC

InChI

InChI=1S/C13H18N2O2/c1-4-10(7-8-14)15-12-9-11(16-2)5-6-13(12)17-3/h5-6,9-10,15H,4,7H2,1-3H3