2-[(2S)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-(4-nitrophenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2S)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-(4-nitrophenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(2S)-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2-(4-nitrophenyl)-5-oxo-2H-pyrrol-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(2S)-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2-(4-nitrophenyl)-5-oxo-2H-pyrrol-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[(2S)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(4-nitrophenyl)-5-oxo-2H-pyrrol-1-yl]ethyl-dimethylazanium Traditional Name: 2-[(5S)-3-hydroxy-2-keto-4-(7-methoxybenzofuran-2-carbonyl)-5-(4-nitrophenyl)-3-pyrrolin-1-yl]ethyl-dimethyl-ammonium Formula: C24H24N3O7+ MolecularWeight: 466.46326

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(C(=C(C1=O)O)C(=O)C2=CC3=C(O2)C(=CC=C3)OC)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCN1[C@H](C(=C(C1=O)O)C(=O)C2=CC3=C(O2)C(=CC=C3)OC)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O7/c1-25(2)11-12-26-20(14-7-9-16(10-8-14)27(31)32)19(22(29)24(26)30)21(28)18-13-15-5-4-6-17(33-3)23(15)34-18/h4-10,13,20,29H,11-12H2,1-3H3/p+1/t20-/m0/s1