methyl 3-methyl-2-[(4-pentylphenyl)sulfonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[(4-pentylphenyl)sulfonylamino]butanoate Openeye Name: methyl 3-methyl-2-[(4-pentylphenyl)sulfonylamino]butanoate CAS Name: 3-methyl-2-[(4-pentylphenyl)sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(4-pentylphenyl)sulfonylamino]butanoate Traditional Name: 2-[(4-amylphenyl)sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C17H27NO4S MolecularWeight: 341.46558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC

InChI

InChI=1S/C17H27NO4S/c1-5-6-7-8-14-9-11-15(12-10-14)23(20,21)18-16(13(2)3)17(19)22-4/h9-13,16,18H,5-8H2,1-4H3