(5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: (5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[2-(2-methylanilino)-2-oxo-ethyl]-propyl-ammonium CAS Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[2-(2-methylanilino)-2-oxoethyl]-propylammonium IUPAC Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[2-(2-methylanilino)-2-oxoethyl]-propylazanium Traditional Name: (5-carbethoxy-2-keto-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[2-keto-2-(o-toluidino)ethyl]-propyl-ammonium Formula: C20H29N4O4+ MolecularWeight: 389.46866

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=C(CNC(=O)N1)C(=O)OCC)CC(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCC[NH+](CC1=C(CNC(=O)N1)C(=O)OCC)CC(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C20H28N4O4/c1-4-10-24(13-18(25)22-16-9-7-6-8-14(16)3)12-17-15(19(26)28-5-2)11-21-20(27)23-17/h6-9H,4-5,10-13H2,1-3H3,(H,22,25)(H2,21,23,27)/p+1