(2R)-3-(1-benzofuran-2-ylcarbonyl)-2-(3-ethoxy-4-oxidanyl-phenyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: (2R)-3-(1-benzofuran-2-ylcarbonyl)-2-(3-ethoxy-4-oxidanyl-phenyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: (2R)-3-(benzofuran-2-carbonyl)-2-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-5-one CAS Name: (2R)-3-[2-benzofuranyl(oxo)methyl]-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-1-[2-(4-morpholin-4-iumyl)ethyl]-2H-pyrrol-5-one IUPAC Name: (2R)-3-(1-benzofuran-2-carbonyl)-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-5-one Traditional Name: (5R)-4-(benzofuran-2-carbonyl)-5-(3-ethoxy-4-hydroxy-phenyl)-3-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-3-pyrrolin-2-one Formula: C27H29N2O7+ MolecularWeight: 493.52836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2CC[NH+]3CCOCC3)O)C(=O)C4=CC5=CC=CC=C5O4)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@@H]2C(=C(C(=O)N2CC[NH+]3CCOCC3)O)C(=O)C4=CC5=CC=CC=C5O4)O

InChI

InChI=1S/C27H28N2O7/c1-2-35-21-16-18(7-8-19(21)30)24-23(25(31)22-15-17-5-3-4-6-20(17)36-22)26(32)27(33)29(24)10-9-28-11-13-34-14-12-28/h3-8,15-16,24,30,32H,2,9-14H2,1H3/p+1/t24-/m1/s1