(E)-2-cyano-N-cyclohexyl-3-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-cyclohexyl-3-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclohexyl-3-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclohexyl-3-[4-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclohexyl-3-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclohexyl-3-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]acrylamide Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(=CC2=CC=C(C=C2)OCC[NH+]3CCOCC3)C#N

Isomeric SMILES

C1CCC(CC1)NC(=O)/C(=C/C2=CC=C(C=C2)OCC[NH+]3CCOCC3)/C#N

InChI

InChI=1S/C22H29N3O3/c23-17-19(22(26)24-20-4-2-1-3-5-20)16-18-6-8-21(9-7-18)28-15-12-25-10-13-27-14-11-25/h6-9,16,20H,1-5,10-15H2,(H,24,26)/p+1/b19-16+