methyl 6-[3-[(4-ethanoylphenyl)sulfonylamino]propanoylamino]hexanoate

Systemtic Name: methyl 6-[3-[(4-ethanoylphenyl)sulfonylamino]propanoylamino]hexanoate Openeye Name: methyl 6-[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]hexanoate CAS Name: 6-[[3-[(4-acetylphenyl)sulfonylamino]-1-oxopropyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]hexanoate Traditional Name: 6-[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]hexanoic acid methyl ester Formula: C18H26N2O6S MolecularWeight: 398.47384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCCCCCC(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C18H26N2O6S/c1-14(21)15-7-9-16(10-8-15)27(24,25)20-13-11-17(22)19-12-5-3-4-6-18(23)26-2/h7-10,20H,3-6,11-13H2,1-2H3,(H,19,22)