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

Systemtic Name: diethyl-[2-[(2R)-3-(furan-2-ylcarbonyl)-4-oxidanyl-5-oxidanylidene-2-(3-propoxyphenyl)-2H-pyrrol-1-yl]ethyl]azanium Openeye Name: diethyl-[2-[(2R)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2-(3-propoxyphenyl)-2H-pyrrol-1-yl]ethyl]ammonium CAS Name: diethyl-[2-[(2R)-3-[2-furanyl(oxo)methyl]-4-hydroxy-5-oxo-2-(3-propoxyphenyl)-2H-pyrrol-1-yl]ethyl]ammonium IUPAC Name: diethyl-[2-[(2R)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2-(3-propoxyphenyl)-2H-pyrrol-1-yl]ethyl]azanium Traditional Name: diethyl-[2-[(5R)-4-(2-furoyl)-3-hydroxy-2-keto-5-(3-propoxyphenyl)-3-pyrrolin-1-yl]ethyl]ammonium Formula: C24H31N2O5+ MolecularWeight: 427.51334

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CC[NH+](CC)CC)O)C(=O)C3=CC=CO3

Isomeric SMILES

CCCOC1=CC=CC(=C1)[C@@H]2C(=C(C(=O)N2CC[NH+](CC)CC)O)C(=O)C3=CC=CO3

InChI

InChI=1S/C24H30N2O5/c1-4-14-30-18-10-7-9-17(16-18)21-20(22(27)19-11-8-15-31-19)23(28)24(29)26(21)13-12-25(5-2)6-3/h7-11,15-16,21,28H,4-6,12-14H2,1-3H3/p+1/t21-/m1/s1