ethyl 2-[(4-butoxyphenyl)sulfonyl-(phenylmethyl)amino]ethanoate

Systemtic Name: ethyl 2-[(4-butoxyphenyl)sulfonyl-(phenylmethyl)amino]ethanoate Openeye Name: ethyl 2-[benzyl-(4-butoxyphenyl)sulfonyl-amino]acetate CAS Name: 2-[(4-butoxyphenyl)sulfonyl-(phenylmethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzyl-(4-butoxyphenyl)sulfonylamino]acetate Traditional Name: 2-[benzyl-(4-butoxyphenyl)sulfonyl-amino]acetic acid ethyl ester Formula: C21H27NO5S MolecularWeight: 405.50778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)OCC

InChI

InChI=1S/C21H27NO5S/c1-3-5-15-27-19-11-13-20(14-12-19)28(24,25)22(17-21(23)26-4-2)16-18-9-7-6-8-10-18/h6-14H,3-5,15-17H2,1-2H3