[(4R)-5-ethoxycarbonyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium

Systemtic Name: [(4R)-5-ethoxycarbonyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium Openeye Name: [(4R)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium CAS Name: [(4R)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium IUPAC Name: [(4R)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-methyl-[2-oxo-2-(propylamino)ethyl]azanium Traditional Name: [(4R)-5-carbethoxy-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-[2-keto-2-(propylamino)ethyl]-methyl-ammonium Formula: C20H29N4O4+ MolecularWeight: 389.46866

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CC1=C(C(NC(=O)N1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCNC(=O)C[NH+](C)CC1=C([C@H](NC(=O)N1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C20H28N4O4/c1-4-11-21-16(25)13-24(3)12-15-17(19(26)28-5-2)18(23-20(27)22-15)14-9-7-6-8-10-14/h6-10,18H,4-5,11-13H2,1-3H3,(H,21,25)(H2,22,23,27)/p+1/t18-/m1/s1