(2S)-3-(furan-2-ylcarbonyl)-2-(4-methylphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: (2S)-3-(furan-2-ylcarbonyl)-2-(4-methylphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: (2S)-3-(furan-2-carbonyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-2-(p-tolyl)-2H-pyrrol-5-one CAS Name: (2S)-3-[2-furanyl(oxo)methyl]-4-hydroxy-2-(4-methylphenyl)-1-[2-(4-morpholin-4-iumyl)ethyl]-2H-pyrrol-5-one IUPAC Name: (2S)-3-(furan-2-carbonyl)-4-hydroxy-2-(4-methylphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-5-one Traditional Name: (5S)-4-(2-furoyl)-3-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-5-(p-tolyl)-3-pyrrolin-2-one Formula: C22H25N2O5+ MolecularWeight: 397.4443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(C(=O)N2CC[NH+]3CCOCC3)O)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2C(=C(C(=O)N2CC[NH+]3CCOCC3)O)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H24N2O5/c1-15-4-6-16(7-5-15)19-18(20(25)17-3-2-12-29-17)21(26)22(27)24(19)9-8-23-10-13-28-14-11-23/h2-7,12,19,26H,8-11,13-14H2,1H3/p+1/t19-/m0/s1