methyl 2-[4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoylamino]-2-methyl-propanoate

Systemtic Name: methyl 2-[4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoylamino]-2-methyl-propanoate Openeye Name: methyl 2-[4-[(4-acetylphenyl)sulfonyl-methyl-amino]butanoylamino]-2-methyl-propanoate CAS Name: 2-[[4-[(4-acetylphenyl)sulfonyl-methylamino]-1-oxobutyl]amino]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[4-[(4-acetylphenyl)sulfonyl-methylamino]butanoylamino]-2-methylpropanoate Traditional Name: 2-[4-[(4-acetylphenyl)sulfonyl-methyl-amino]butanoylamino]-2-methyl-propionic 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)N(C)CCCC(=O)NC(C)(C)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC(C)(C)C(=O)OC

InChI

InChI=1S/C18H26N2O6S/c1-13(21)14-8-10-15(11-9-14)27(24,25)20(4)12-6-7-16(22)19-18(2,3)17(23)26-5/h8-11H,6-7,12H2,1-5H3,(H,19,22)