(2R)-1-(4-methoxy-3-nitro-phenyl)-2-(4-methylquinolin-1-ium-1-yl)propan-1-one

Systemtic Name: (2R)-1-(4-methoxy-3-nitro-phenyl)-2-(4-methylquinolin-1-ium-1-yl)propan-1-one Openeye Name: (2R)-1-(4-methoxy-3-nitro-phenyl)-2-(4-methylquinolin-1-ium-1-yl)propan-1-one CAS Name: (2R)-1-(4-methoxy-3-nitrophenyl)-2-(4-methyl-1-quinolin-1-iumyl)-1-propanone IUPAC Name: (2R)-1-(4-methoxy-3-nitrophenyl)-2-(4-methylquinolin-1-ium-1-yl)propan-1-one Traditional Name: (2R)-1-(4-methoxy-3-nitro-phenyl)-2-(4-methylquinolin-1-ium-1-yl)propan-1-one Formula: C20H19N2O4+ MolecularWeight: 351.37586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C2=CC=CC=C12)C(C)C(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=[N+](C2=CC=CC=C12)[C@H](C)C(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H19N2O4/c1-13-10-11-21(17-7-5-4-6-16(13)17)14(2)20(23)15-8-9-19(26-3)18(12-15)22(24)25/h4-12,14H,1-3H3/q+1/t14-/m1/s1