(E)-3-[4-(hexadecylamino)phenyl]-N-methylsulfonyl-prop-2-enamide

Systemtic Name: (E)-3-[4-(hexadecylamino)phenyl]-N-methylsulfonyl-prop-2-enamide Openeye Name: (E)-3-[4-(hexadecylamino)phenyl]-N-methylsulfonyl-prop-2-enamide CAS Name: (E)-3-[4-(hexadecylamino)phenyl]-N-methylsulfonyl-2-propenamide IUPAC Name: (E)-3-[4-(hexadecylamino)phenyl]-N-methylsulfonylprop-2-enamide Traditional Name: (E)-3-[4-(cetylamino)phenyl]-N-mesyl-acrylamide Formula: C26H44N2O3S MolecularWeight: 464.70416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C=CC(=O)NS(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)/C=C/C(=O)NS(=O)(=O)C

InChI

InChI=1S/C26H44N2O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-27-25-20-17-24(18-21-25)19-22-26(29)28-32(2,30)31/h17-22,27H,3-16,23H2,1-2H3,(H,28,29)/b22-19+