diethyl-[3-[(2R)-3-(furan-2-ylcarbonyl)-4-oxidanyl-5-oxidanylidene-2-(4-propan-2-yloxyphenyl)-2H-pyrrol-1-yl]propyl]azanium

Systemtic Name: diethyl-[3-[(2R)-3-(furan-2-ylcarbonyl)-4-oxidanyl-5-oxidanylidene-2-(4-propan-2-yloxyphenyl)-2H-pyrrol-1-yl]propyl]azanium Openeye Name: diethyl-[3-[(2R)-3-(furan-2-carbonyl)-4-hydroxy-2-(4-isopropoxyphenyl)-5-oxo-2H-pyrrol-1-yl]propyl]ammonium CAS Name: diethyl-[3-[(2R)-3-[2-furanyl(oxo)methyl]-4-hydroxy-5-oxo-2-(4-propan-2-yloxyphenyl)-2H-pyrrol-1-yl]propyl]ammonium IUPAC Name: diethyl-[3-[(2R)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2-(4-propan-2-yloxyphenyl)-2H-pyrrol-1-yl]propyl]azanium Traditional Name: diethyl-[3-[(2R)-3-(2-furoyl)-4-hydroxy-2-(4-isopropoxyphenyl)-5-keto-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=CO2)C3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CC[NH+](CC)CCCN1[C@@H](C(=C(C1=O)O)C(=O)C2=CC=CO2)C3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C25H32N2O5/c1-5-26(6-2)14-8-15-27-22(18-10-12-19(13-11-18)32-17(3)4)21(24(29)25(27)30)23(28)20-9-7-16-31-20/h7,9-13,16-17,22,29H,5-6,8,14-15H2,1-4H3/p+1/t22-/m1/s1