3-methylbutyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate

Systemtic Name: 3-methylbutyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate Openeye Name: isopentyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-ethoxyphenyl)sulfonylamino]propanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate Traditional Name: 3-(p-phenetylsulfonylamino)propionic acid isoamyl ester Formula: C16H25NO5S MolecularWeight: 343.4384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCCC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCCC(C)C

InChI

InChI=1S/C16H25NO5S/c1-4-21-14-5-7-15(8-6-14)23(19,20)17-11-9-16(18)22-12-10-13(2)3/h5-8,13,17H,4,9-12H2,1-3H3