1-methyl-3-[methyl(oxidanyl)amino]-4-(4-phenylmethoxyphenyl)-1-pyridin-3-yl-2H-pyrrol-1-ium-5-one

Systemtic Name: 1-methyl-3-[methyl(oxidanyl)amino]-4-(4-phenylmethoxyphenyl)-1-pyridin-3-yl-2H-pyrrol-1-ium-5-one Openeye Name: 4-(4-benzyloxyphenyl)-3-[hydroxy(methyl)amino]-1-methyl-1-(3-pyridyl)-2H-pyrrol-1-ium-5-one CAS Name: 3-[hydroxy(methyl)amino]-1-methyl-4-(4-phenylmethoxyphenyl)-1-(3-pyridinyl)-2H-pyrrol-1-ium-5-one IUPAC Name: 3-[hydroxy(methyl)amino]-1-methyl-4-(4-phenylmethoxyphenyl)-1-pyridin-3-yl-2H-pyrrol-1-ium-5-one Traditional Name: 3-(4-benzoxyphenyl)-4-[hydroxy(methyl)amino]-1-methyl-1-(3-pyridyl)-3-pyrrolin-1-ium-2-one Formula: C24H24N3O3+ MolecularWeight: 402.46566

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C(=O)[N+](C1)(C)C2=CN=CC=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

CN(C1=C(C(=O)[N+](C1)(C)C2=CN=CC=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C24H24N3O3/c1-26(29)22-16-27(2,20-9-6-14-25-15-20)24(28)23(22)19-10-12-21(13-11-19)30-17-18-7-4-3-5-8-18/h3-15,29H,16-17H2,1-2H3/q+1