3-[(2R)-2-(4-ethoxyphenyl)-3-(5-methylfuran-2-yl)carbonyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]propyl-diethyl-azanium

Systemtic Name: 3-[(2R)-2-(4-ethoxyphenyl)-3-(5-methylfuran-2-yl)carbonyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]propyl-diethyl-azanium Openeye Name: 3-[(2R)-2-(4-ethoxyphenyl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-5-oxo-2H-pyrrol-1-yl]propyl-diethyl-ammonium CAS Name: 3-[(2R)-2-(4-ethoxyphenyl)-4-hydroxy-3-[(5-methyl-2-furanyl)-oxomethyl]-5-oxo-2H-pyrrol-1-yl]propyl-diethylammonium IUPAC Name: 3-[(2R)-2-(4-ethoxyphenyl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-5-oxo-2H-pyrrol-1-yl]propyl-diethylazanium Traditional Name: diethyl-[3-[(5R)-3-hydroxy-2-keto-4-(5-methyl-2-furoyl)-5-p-phenetyl-3-pyrrolin-1-yl]propyl]ammonium Formula: C25H33N2O5+ MolecularWeight: 441.53992

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(C(=C(C1=O)O)C(=O)C2=CC=C(O2)C)C3=CC=C(C=C3)OCC

Isomeric SMILES

CC[NH+](CC)CCCN1[C@@H](C(=C(C1=O)O)C(=O)C2=CC=C(O2)C)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C25H32N2O5/c1-5-26(6-2)15-8-16-27-22(18-10-12-19(13-11-18)31-7-3)21(24(29)25(27)30)23(28)20-14-9-17(4)32-20/h9-14,22,29H,5-8,15-16H2,1-4H3/p+1/t22-/m1/s1