N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C17H30N5O3+ MolecularWeight: 352.4518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C[NH+]2CCCC2

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C[NH+]2CCCC2

InChI

InChI=1S/C17H29N5O3/c1-3-5-11-21(13(23)12-20-9-6-7-10-20)14-15(18)22(8-4-2)17(25)19-16(14)24/h3-12,18H2,1-2H3,(H,19,24,25)/p+1