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

Systemtic Name: 6-azanyl-5-[2-(azepan-1-ium-1-yl)ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(azepan-1-ium-1-yl)acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-(1-azepan-1-iumyl)-1-oxoethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(azepan-1-ium-1-yl)acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(azepan-1-ium-1-yl)acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C15H25N4O3+ MolecularWeight: 309.384

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCCCCC2)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCCCCC2)N

InChI

InChI=1S/C15H24N4O3/c1-2-7-19-13(16)12(14(21)17-15(19)22)11(20)10-18-8-5-3-4-6-9-18/h2-10,16H2,1H3,(H,17,21,22)/p+1