[2-(azocan-1-yl)-2-oxidanylidene-ethyl] 3-[(2-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] 3-[(2-chlorophenyl)sulfonylamino]propanoate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] 3-[(2-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(2-chlorophenyl)sulfonylamino]propanoic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] 3-[(2-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(2-chlorophenyl)sulfonylamino]propionic acid [2-(azocan-1-yl)-2-keto-ethyl] ester Formula: C18H25ClN2O5S MolecularWeight: 416.9195

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)COC(=O)CCNS(=O)(=O)C2=CC=CC=C2Cl

Isomeric SMILES

C1CCCN(CCC1)C(=O)COC(=O)CCNS(=O)(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H25ClN2O5S/c19-15-8-4-5-9-16(15)27(24,25)20-11-10-18(23)26-14-17(22)21-12-6-2-1-3-7-13-21/h4-5,8-9,20H,1-3,6-7,10-14H2