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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCC(CC=O)(C2=CC3=C(CCC3)C=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCC(CC=O)(C2=CC3=C(CCC3)C=C2)C(=O)O

InChI

InChI=1S/C21H23NO6S/c1-28-18-7-9-19(10-8-18)29(26,27)22-14-21(11-12-23,20(24)25)17-6-5-15-3-2-4-16(15)13-17/h5-10,12-13,22H,2-4,11,14H2,1H3,(H,24,25)