2-[[2-(4-ethoxycarbonyl-5-methyl-3-phenyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethanoyl]amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[2-(4-ethoxycarbonyl-5-methyl-3-phenyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethanoyl]amino]ethyl-diethyl-azanium Openeye Name: 2-[[2-(4-ethoxycarbonyl-5-methyl-3-phenyl-1H-pyrrol-2-yl)-2-oxo-acetyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[2-(4-ethoxycarbonyl-5-methyl-3-phenyl-1H-pyrrol-2-yl)-1,2-dioxoethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[2-(4-ethoxycarbonyl-5-methyl-3-phenyl-1H-pyrrol-2-yl)-2-oxoacetyl]amino]ethyl-diethylazanium Traditional Name: 2-[[2-(4-carbethoxy-5-methyl-3-phenyl-1H-pyrrol-2-yl)-2-keto-acetyl]amino]ethyl-diethyl-ammonium Formula: C22H30N3O4+ MolecularWeight: 400.4913

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C2=CC=CC=C2

InChI

InChI=1S/C22H29N3O4/c1-5-25(6-2)14-13-23-21(27)20(26)19-18(16-11-9-8-10-12-16)17(15(4)24-19)22(28)29-7-3/h8-12,24H,5-7,13-14H2,1-4H3,(H,23,27)/p+1