2-[1-[[(4-methoxyphenyl)sulfonylamino]methyl]-2,3-dihydro-1H-inden-5-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-[1-[[(4-methoxyphenyl)sulfonylamino]methyl]-2,3-dihydro-1H-inden-5-yl]-4-oxidanylidene-butanoic acid Openeye Name: 2-[1-[[(4-methoxyphenyl)sulfonylamino]methyl]indan-5-yl]-4-oxo-butanoic acid CAS Name: 2-[1-[[(4-methoxyphenyl)sulfonylamino]methyl]-2,3-dihydro-1H-inden-5-yl]-4-oxobutanoic acid IUPAC Name: 2-[1-[[(4-methoxyphenyl)sulfonylamino]methyl]-2,3-dihydro-1H-inden-5-yl]-4-oxobutanoic acid Traditional Name: 4-keto-2-[1-[[(4-methoxyphenyl)sulfonylamino]methyl]indan-5-yl]butyric acid Formula: C21H23NO6S MolecularWeight: 417.47542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCC2CCC3=C2C=CC(=C3)C(CC=O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCC2CCC3=C2C=CC(=C3)C(CC=O)C(=O)O

InChI

InChI=1S/C21H23NO6S/c1-28-17-5-7-18(8-6-17)29(26,27)22-13-16-3-2-14-12-15(4-9-19(14)16)20(10-11-23)21(24)25/h4-9,11-12,16,20,22H,2-3,10,13H2,1H3,(H,24,25)