N-(4-methoxy-2-nitro-phenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide CAS Name: N-(4-methoxy-2-nitrophenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide Formula: C20H22N3O4+ MolecularWeight: 368.40638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC(=CC2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC(=CC2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O4/c1-27-17-7-8-18(19(13-17)23(25)26)21-20(24)14-22-11-9-16(10-12-22)15-5-3-2-4-6-15/h2-9,13H,10-12,14H2,1H3,(H,21,24)/p+1