(2S)-3-(1-benzofuran-2-ylcarbonyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one

Systemtic Name: (2S)-3-(1-benzofuran-2-ylcarbonyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one Openeye Name: (2S)-3-(benzofuran-2-carbonyl)-4-hydroxy-2-(4-isopropylphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-5-one CAS Name: (2S)-3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-1-[2-(4-morpholin-4-iumyl)ethyl]-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one IUPAC Name: (2S)-3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one Traditional Name: (5S)-4-(benzofuran-2-carbonyl)-3-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-5-p-cumenyl-3-pyrrolin-2-one Formula: C28H31N2O5+ MolecularWeight: 475.55614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H30N2O5/c1-18(2)19-7-9-20(10-8-19)25-24(26(31)23-17-21-5-3-4-6-22(21)35-23)27(32)28(33)30(25)12-11-29-13-15-34-16-14-29/h3-10,17-18,25,32H,11-16H2,1-2H3/p+1/t25-/m0/s1