[1-(heptylamino)-1-oxidanylidene-hexan-2-yl] hydrogen sulfite

Systemtic Name: [1-(heptylamino)-1-oxidanylidene-hexan-2-yl] hydrogen sulfite Openeye Name: 1-(heptylcarbamoyl)pentyl hydrogen sulfite CAS Name: sulfurous acid [1-(heptylamino)-1-oxohexan-2-yl] ester IUPAC Name: [1-(heptylamino)-1-oxohexan-2-yl] hydrogen sulfite Traditional Name: sulfurous acid 1-(heptylcarbamoyl)pentyl ester Formula: C13H27NO4S MolecularWeight: 293.42278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C(CCCC)OS(=O)O

Isomeric SMILES

CCCCCCCNC(=O)C(CCCC)OS(=O)O

InChI

InChI=1S/C13H27NO4S/c1-3-5-7-8-9-11-14-13(15)12(10-6-4-2)18-19(16)17/h12H,3-11H2,1-2H3,(H,14,15)(H,16,17)