(E)-3-(3-chlorophenyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(3-chlorophenyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]prop-2-enamide Openeye Name: (E)-3-(3-chlorophenyl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]prop-2-enamide CAS Name: (E)-3-(3-chlorophenyl)-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-propenamide IUPAC Name: (E)-3-(3-chlorophenyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]prop-2-enamide Traditional Name: (E)-3-(3-chlorophenyl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]acrylamide Formula: C19H21ClN3O2+ MolecularWeight: 358.84194

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C=CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)/C=C/C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H20ClN3O2/c20-17-3-1-2-15(12-17)5-7-19(24)22-14-16-4-6-18(21-13-16)23-8-10-25-11-9-23/h1-7,12-13H,8-11,14H2,(H,22,24)/p+1/b7-5+