2-[4-(heptan-4-ylamino)phenoxy]ethanenitrile

Systemtic Name: 2-[4-(heptan-4-ylamino)phenoxy]ethanenitrile Openeye Name: 2-[4-(1-propylbutylamino)phenoxy]acetonitrile CAS Name: 2-[4-(heptan-4-ylamino)phenoxy]acetonitrile IUPAC Name: 2-[4-(heptan-4-ylamino)phenoxy]acetonitrile Traditional Name: 2-[4-(1-propylbutylamino)phenoxy]acetonitrile Formula: C15H22N2O MolecularWeight: 246.34798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=CC=C(C=C1)OCC#N

Isomeric SMILES

CCCC(CCC)NC1=CC=C(C=C1)OCC#N

InChI

InChI=1S/C15H22N2O/c1-3-5-13(6-4-2)17-14-7-9-15(10-8-14)18-12-11-16/h7-10,13,17H,3-6,12H2,1-2H3