3-[2-(butylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-4-propyl-azetidine-3-sulfonic acid

Systemtic Name: 3-[2-(butylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-4-propyl-azetidine-3-sulfonic acid Openeye Name: 3-[2-(butylamino)-2-oxo-ethyl]-2-oxo-4-propyl-azetidine-3-sulfonic acid CAS Name: 3-[2-(butylamino)-2-oxoethyl]-2-oxo-4-propyl-3-azetidinesulfonic acid IUPAC Name: 3-[2-(butylamino)-2-oxoethyl]-2-oxo-4-propylazetidine-3-sulfonic acid Traditional Name: 3-[2-(butylamino)-2-keto-ethyl]-2-keto-4-propyl-azetidine-3-sulfonic acid Formula: C12H22N2O5S MolecularWeight: 306.37848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC1(C(NC1=O)CCC)S(=O)(=O)O

Isomeric SMILES

CCCCNC(=O)CC1(C(NC1=O)CCC)S(=O)(=O)O

InChI

InChI=1S/C12H22N2O5S/c1-3-5-7-13-10(15)8-12(20(17,18)19)9(6-4-2)14-11(12)16/h9H,3-8H2,1-2H3,(H,13,15)(H,14,16)(H,17,18,19)