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

Systemtic Name: 3-[2-[(2,4-ditert-butylphenyl)sulfonylamino]-2,3-dihydro-1H-inden-5-yl]propanoic acid Openeye Name: 3-[2-[(2,4-ditert-butylphenyl)sulfonylamino]indan-5-yl]propanoic acid CAS Name: 3-[2-[(2,4-ditert-butylphenyl)sulfonylamino]-2,3-dihydro-1H-inden-5-yl]propanoic acid IUPAC Name: 3-[2-[(2,4-ditert-butylphenyl)sulfonylamino]-2,3-dihydro-1H-inden-5-yl]propanoic acid Traditional Name: 3-[2-[(2,4-ditert-butylphenyl)sulfonylamino]indan-5-yl]propionic acid Formula: C26H35NO4S MolecularWeight: 457.6254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)S(=O)(=O)NC2CC3=C(C2)C=C(C=C3)CCC(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)S(=O)(=O)NC2CC3=C(C2)C=C(C=C3)CCC(=O)O)C(C)(C)C

InChI

InChI=1S/C26H35NO4S/c1-25(2,3)20-10-11-23(22(16-20)26(4,5)6)32(30,31)27-21-14-18-9-7-17(8-12-24(28)29)13-19(18)15-21/h7,9-11,13,16,21,27H,8,12,14-15H2,1-6H3,(H,28,29)