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

Systemtic Name: (E)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-(2-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]-3-(2-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-3-(2-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-(2-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]-3-(2-nitrophenyl)acrylamide Formula: C19H21N4O4+ MolecularWeight: 369.39444

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=[NH+]2)CNC(=O)C=CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=CC=[NH+]2)CNC(=O)/C=C/C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O4/c24-18(8-7-15-4-1-2-6-17(15)23(25)26)21-14-16-5-3-9-20-19(16)22-10-12-27-13-11-22/h1-9H,10-14H2,(H,21,24)/p+1/b8-7+