[(3-methyl-1-sulfooxy-butan-2-yl)amino] dodecanoate

Systemtic Name: [(3-methyl-1-sulfooxy-butan-2-yl)amino] dodecanoate Openeye Name: [[2-methyl-1-(sulfooxymethyl)propyl]amino] dodecanoate CAS Name: dodecanoic acid [(3-methyl-1-sulfooxybutan-2-yl)amino] ester IUPAC Name: [(3-methyl-1-sulfooxybutan-2-yl)amino] dodecanoate Traditional Name: lauric acid [[2-methyl-1-(sulfoxymethyl)propyl]amino] ester Formula: C17H35NO6S MolecularWeight: 381.5279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)ONC(COS(=O)(=O)O)C(C)C

Isomeric SMILES

CCCCCCCCCCCC(=O)ONC(COS(=O)(=O)O)C(C)C

InChI

InChI=1S/C17H35NO6S/c1-4-5-6-7-8-9-10-11-12-13-17(19)24-18-16(15(2)3)14-23-25(20,21)22/h15-16,18H,4-14H2,1-3H3,(H,20,21,22)