[2-(cyclopentylamino)-2-oxidanylidene-ethyl] 2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] 2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] 2,4-dichloro-5-morpholinosulfonyl-benzoate CAS Name: 2,4-dichloro-5-(4-morpholinylsulfonyl)benzoic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] 2,4-dichloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2,4-dichloro-5-morpholinosulfonyl-benzoic acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C18H22Cl2N2O6S MolecularWeight: 465.34808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)COC(=O)C2=CC(=C(C=C2Cl)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C1CCC(C1)NC(=O)COC(=O)C2=CC(=C(C=C2Cl)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H22Cl2N2O6S/c19-14-10-15(20)16(29(25,26)22-5-7-27-8-6-22)9-13(14)18(24)28-11-17(23)21-12-3-1-2-4-12/h9-10,12H,1-8,11H2,(H,21,23)