6-azanyl-5-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C18H24N5O5+ MolecularWeight: 390.41366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3)N

InChI

InChI=1S/C18H23N5O5/c1-2-5-23-15(19)14(16(25)20-18(23)27)12(24)11-21-6-8-22(9-7-21)17(26)13-4-3-10-28-13/h3-4,10H,2,5-9,11,19H2,1H3,(H,20,25,27)/p+1