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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C18H32N5O3+ MolecularWeight: 366.47838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C[NH+]2CCCC2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C[NH+]2CCCC2)N

InChI

InChI=1S/C18H31N5O3/c1-3-5-11-22(14(24)13-21-9-7-8-10-21)15-16(19)23(12-6-4-2)18(26)20-17(15)25/h3-13,19H2,1-2H3,(H,20,25,26)/p+1