[1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 3-[(3-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 3-[(3-chlorophenyl)sulfonylamino]propanoate Openeye Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) 3-[(3-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(3-chlorophenyl)sulfonylamino]propanoic acid [1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] 3-[(3-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-chlorophenyl)sulfonylamino]propionic acid (2-indan-5-yl-2-keto-1-methyl-ethyl) ester Formula: C21H22ClNO5S MolecularWeight: 435.92108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)OC(=O)CCNS(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)C1=CC2=C(CCC2)C=C1)OC(=O)CCNS(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H22ClNO5S/c1-14(21(25)17-9-8-15-4-2-5-16(15)12-17)28-20(24)10-11-23-29(26,27)19-7-3-6-18(22)13-19/h3,6-9,12-14,23H,2,4-5,10-11H2,1H3