[2-oxidanylidene-2-(pentylamino)ethyl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-oxo-2-(pentylamino)ethyl] 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid [2-(amylamino)-2-keto-ethyl] ester Formula: C19H28N2O6S MolecularWeight: 412.50042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)C

Isomeric SMILES

CCCCCNC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)C

InChI

InChI=1S/C19H28N2O6S/c1-3-4-5-8-20-18(22)14-27-19(23)17-13-16(7-6-15(17)2)28(24,25)21-9-11-26-12-10-21/h6-7,13H,3-5,8-12,14H2,1-2H3,(H,20,22)