3-[(4-tert-butylphenyl)sulfonylamino]-2-(2,3-dihydro-1H-inden-5-yl)propanoic acid

Systemtic Name: 3-[(4-tert-butylphenyl)sulfonylamino]-2-(2,3-dihydro-1H-inden-5-yl)propanoic acid Openeye Name: 3-[(4-tert-butylphenyl)sulfonylamino]-2-indan-5-yl-propanoic acid CAS Name: 3-[(4-tert-butylphenyl)sulfonylamino]-2-(2,3-dihydro-1H-inden-5-yl)propanoic acid IUPAC Name: 3-[(4-tert-butylphenyl)sulfonylamino]-2-(2,3-dihydro-1H-inden-5-yl)propanoic acid Traditional Name: 3-[(4-tert-butylphenyl)sulfonylamino]-2-indan-5-yl-propionic acid Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO4S/c1-22(2,3)18-9-11-19(12-10-18)28(26,27)23-14-20(21(24)25)17-8-7-15-5-4-6-16(15)13-17/h7-13,20,23H,4-6,14H2,1-3H3,(H,24,25)