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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-cyclopentyl-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-cyclopentyl-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-cyclopentyl-2-(4-hydroxy-1-piperidin-1-iumyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-cyclopentyl-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-cyclopentyl-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide Formula: C20H34N5O4+ MolecularWeight: 408.51506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)C[NH+]3CCC(CC3)O)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)C[NH+]3CCC(CC3)O)N

InChI

InChI=1S/C20H33N5O4/c1-2-3-10-24-18(21)17(19(28)22-20(24)29)25(14-6-4-5-7-14)16(27)13-23-11-8-15(26)9-12-23/h14-15,26H,2-13,21H2,1H3,(H,22,28,29)/p+1