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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(azepan-1-ium-1-yl)-N-(2-methoxyethyl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(azepan-1-ium-1-yl)-N-(2-methoxyethyl)acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(1-azepan-1-iumyl)-N-(2-methoxyethyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(azepan-1-ium-1-yl)-N-(2-methoxyethyl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(azepan-1-ium-1-yl)-N-(2-methoxyethyl)acetamide Formula: C19H34N5O4+ MolecularWeight: 396.50436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C[NH+]2CCCCCC2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C[NH+]2CCCCCC2)N

InChI

InChI=1S/C19H33N5O4/c1-3-4-11-24-17(20)16(18(26)21-19(24)27)23(12-13-28-2)15(25)14-22-9-7-5-6-8-10-22/h3-14,20H2,1-2H3,(H,21,26,27)/p+1