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

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-yl)-3-[(4-methylphenyl)sulfonylamino]propanoic acid Openeye Name: 2-indan-5-yl-3-(p-tolylsulfonylamino)propanoic acid CAS Name: 2-(2,3-dihydro-1H-inden-5-yl)-3-[(4-methylphenyl)sulfonylamino]propanoic acid IUPAC Name: 2-(2,3-dihydro-1H-inden-5-yl)-3-[(4-methylphenyl)sulfonylamino]propanoic acid Traditional Name: 2-indan-5-yl-3-(tosylamino)propionic acid Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC3=C(CCC3)C=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC3=C(CCC3)C=C2)C(=O)O

InChI

InChI=1S/C19H21NO4S/c1-13-5-9-17(10-6-13)25(23,24)20-12-18(19(21)22)16-8-7-14-3-2-4-15(14)11-16/h5-11,18,20H,2-4,12H2,1H3,(H,21,22)