(E)-3-[4-(hexadecylamino)phenyl]prop-2-enenitrile

Systemtic Name: (E)-3-[4-(hexadecylamino)phenyl]prop-2-enenitrile Openeye Name: (E)-3-[4-(hexadecylamino)phenyl]prop-2-enenitrile CAS Name: (E)-3-[4-(hexadecylamino)phenyl]-2-propenenitrile IUPAC Name: (E)-3-[4-(hexadecylamino)phenyl]prop-2-enenitrile Traditional Name: (E)-3-[4-(cetylamino)phenyl]acrylonitrile Formula: C25H40N2 MolecularWeight: 368.5985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C=CC#N

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)/C=C/C#N

InChI

InChI=1S/C25H40N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-27-25-20-18-24(19-21-25)17-16-22-26/h16-21,27H,2-15,23H2,1H3/b17-16+