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

Systemtic Name: 2-[[2-[4-ethoxycarbonyl-5-methyl-3-(4-methylphenyl)-1H-pyrrol-2-yl]-2-oxidanylidene-ethanoyl]amino]ethyl-diethyl-azanium Openeye Name: 2-[[2-[4-ethoxycarbonyl-5-methyl-3-(p-tolyl)-1H-pyrrol-2-yl]-2-oxo-acetyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[2-[4-ethoxycarbonyl-5-methyl-3-(4-methylphenyl)-1H-pyrrol-2-yl]-1,2-dioxoethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[2-[4-ethoxycarbonyl-5-methyl-3-(4-methylphenyl)-1H-pyrrol-2-yl]-2-oxoacetyl]amino]ethyl-diethylazanium Traditional Name: 2-[[2-[4-carbethoxy-5-methyl-3-(p-tolyl)-1H-pyrrol-2-yl]-2-keto-acetyl]amino]ethyl-diethyl-ammonium Formula: C23H32N3O4+ MolecularWeight: 414.51788

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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=C(C=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O4/c1-6-26(7-2)14-13-24-22(28)21(27)20-19(17-11-9-15(4)10-12-17)18(16(5)25-20)23(29)30-8-3/h9-12,25H,6-8,13-14H2,1-5H3,(H,24,28)/p+1