[(1S,2R)-1-[(4-methylphenyl)sulfonylamino]-2,3-dihydro-1H-inden-2-yl] octanoate

Systemtic Name: [(1S,2R)-1-[(4-methylphenyl)sulfonylamino]-2,3-dihydro-1H-inden-2-yl] octanoate Openeye Name: [(1S,2R)-1-(p-tolylsulfonylamino)indan-2-yl] octanoate CAS Name: octanoic acid [(1S,2R)-1-[(4-methylphenyl)sulfonylamino]-2,3-dihydro-1H-inden-2-yl] ester IUPAC Name: [(1S,2R)-1-[(4-methylphenyl)sulfonylamino]-2,3-dihydro-1H-inden-2-yl] octanoate Traditional Name: caprylic acid [(1S,2R)-1-(tosylamino)indan-2-yl] ester Formula: C24H31NO4S MolecularWeight: 429.57224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1CC2=CC=CC=C2C1NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCC(=O)O[C@@H]1CC2=CC=CC=C2[C@@H]1NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H31NO4S/c1-3-4-5-6-7-12-23(26)29-22-17-19-10-8-9-11-21(19)24(22)25-30(27,28)20-15-13-18(2)14-16-20/h8-11,13-16,22,24-25H,3-7,12,17H2,1-2H3/t22-,24+/m1/s1