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

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

Systemtic Name:diethyl-[3-[(2S)-3-(furan-2-ylcarbonyl)-2-(5-methylfuran-2-yl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]propyl]azanium
Openeye Name:diethyl-[3-[(2S)-3-(furan-2-carbonyl)-4-hydroxy-2-(5-methyl-2-furyl)-5-oxo-2H-pyrrol-1-yl]propyl]ammonium
CAS Name:diethyl-[3-[(2S)-3-[2-furanyl(oxo)methyl]-4-hydroxy-2-(5-methyl-2-furanyl)-5-oxo-2H-pyrrol-1-yl]propyl]ammonium
IUPAC Name:diethyl-[3-[(2S)-3-(furan-2-carbonyl)-4-hydroxy-2-(5-methylfuran-2-yl)-5-oxo-2H-pyrrol-1-yl]propyl]azanium
Traditional Name:diethyl-[3-[(5S)-4-(2-furoyl)-3-hydroxy-2-keto-5-(5-methyl-2-furyl)-3-pyrrolin-1-yl]propyl]ammonium
Formula: C21H27N2O5+
MolecularWeight: 387.44948
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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(O3)C


Isomeric SMILES

CC[NH+](CC)CCCN1[C@@H](C(=C(C1=O)O)C(=O)C2=CC=CO2)C3=CC=C(O3)C


InChI

InChI=1S/C21H26N2O5/c1-4-22(5-2)11-7-12-23-18(15-10-9-14(3)28-15)17(20(25)21(23)26)19(24)16-8-6-13-27-16/h6,8-10,13,18,25H,4-5,7,11-12H2,1-3H3/p+1/t18-/m1/s1


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