[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2,4-dichloro-5-morpholinosulfonyl-benzoate CAS Name: 2,4-dichloro-5-(4-morpholinylsulfonyl)benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2,4-dichloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2,4-dichloro-5-morpholinosulfonyl-benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C18H24Cl2N2O6S MolecularWeight: 467.36396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC(=C(C=C1Cl)Cl)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC(=C(C=C1Cl)Cl)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C18H24Cl2N2O6S/c1-3-12(4-2)21-17(23)11-28-18(24)13-9-16(15(20)10-14(13)19)29(25,26)22-5-7-27-8-6-22/h9-10,12H,3-8,11H2,1-2H3,(H,21,23)