(3R)-3-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-(1-oxidanidylpyridin-1-ium-2-yl)-3-phenyl-propan-1-one

Systemtic Name: (3R)-3-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-(1-oxidanidylpyridin-1-ium-2-yl)-3-phenyl-propan-1-one Openeye Name: (3R)-3-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-(1-oxidopyridin-1-ium-2-yl)-3-phenyl-propan-1-one CAS Name: (3R)-3-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-(1-oxido-2-pyridin-1-iumyl)-3-phenyl-1-propanone IUPAC Name: (3R)-3-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-(1-oxidopyridin-1-ium-2-yl)-3-phenylpropan-1-one Traditional Name: (3R)-3-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-(1-oxidopyridin-1-ium-2-yl)-3-phenyl-propan-1-one Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(CC(=O)C2=CC=CC=[N+]2[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)[C@H](CC(=O)C2=CC=CC=[N+]2[O-])C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3/c1-14-21(16(3)25)15(2)23-22(14)18(17-9-5-4-6-10-17)13-20(26)19-11-7-8-12-24(19)27/h4-12,18,23H,13H2,1-3H3/t18-/m1/s1