[2-(4-butylphenyl)-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [2-(4-butylphenyl)-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Openeye Name: [2-(4-butylphenyl)-2-oxo-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-chlorophenyl)sulfonylamino]propanoic acid [2-(4-butylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-butylphenyl)-2-oxoethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-chlorophenyl)sulfonylamino]propionic acid [2-(4-butylphenyl)-2-keto-ethyl] ester Formula: C21H24ClNO5S MolecularWeight: 437.93696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClNO5S/c1-2-3-4-16-5-7-17(8-6-16)20(24)15-28-21(25)13-14-23-29(26,27)19-11-9-18(22)10-12-19/h5-12,23H,2-4,13-15H2,1H3