(1-carbamimidoylpiperidin-3-yl)methyl N-methylcarbamate; sulfurous acid

Systemtic Name: (1-carbamimidoylpiperidin-3-yl)methyl N-methylcarbamate; sulfurous acid Openeye Name: (1-carbamimidoyl-3-piperidyl)methyl N-methylcarbamate; sulfurous acid CAS Name: N-methylcarbamic acid (1-carbamimidoyl-3-piperidinyl)methyl ester; sulfurous acid IUPAC Name: (1-carbamimidoylpiperidin-3-yl)methyl N-methylcarbamate; sulfurous acid Traditional Name: N-methylcarbamic acid (1-amidino-3-piperidyl)methyl ester; sulfurous acid Formula: C9H20N4O5S MolecularWeight: 296.3439

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OCC1CCCN(C1)C(=N)N.OS(=O)O

Isomeric SMILES

CNC(=O)OCC1CCCN(C1)C(=N)N.OS(=O)O

InChI

InChI=1S/C9H18N4O2.H2O3S/c1-12-9(14)15-6-7-3-2-4-13(5-7)8(10)11;1-4(2)3/h7H,2-6H2,1H3,(H3,10,11)(H,12,14);(H2,1,2,3)