(2-propoxyphenyl) 4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoate

Systemtic Name: (2-propoxyphenyl) 4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoate Openeye Name: (2-propoxyphenyl) 4-[(4-acetylphenyl)sulfonyl-methyl-amino]butanoate CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]butanoic acid (2-propoxyphenyl) ester IUPAC Name: (2-propoxyphenyl) 4-[(4-acetylphenyl)sulfonyl-methylamino]butanoate Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]butyric acid (2-propoxyphenyl) ester Formula: C22H27NO6S MolecularWeight: 433.51788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1OC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCCOC1=CC=CC=C1OC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C22H27NO6S/c1-4-16-28-20-8-5-6-9-21(20)29-22(25)10-7-15-23(3)30(26,27)19-13-11-18(12-14-19)17(2)24/h5-6,8-9,11-14H,4,7,10,15-16H2,1-3H3