[2-(hexylamino)-2-oxidanylidene-ethyl] 2-ethylsulfonylbenzoate

Systemtic Name: [2-(hexylamino)-2-oxidanylidene-ethyl] 2-ethylsulfonylbenzoate Openeye Name: [2-(hexylamino)-2-oxo-ethyl] 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [2-(hexylamino)-2-oxoethyl] ester IUPAC Name: [2-(hexylamino)-2-oxoethyl] 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid [2-(hexylamino)-2-keto-ethyl] ester Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)COC(=O)C1=CC=CC=C1S(=O)(=O)CC

Isomeric SMILES

CCCCCCNC(=O)COC(=O)C1=CC=CC=C1S(=O)(=O)CC

InChI

InChI=1S/C17H25NO5S/c1-3-5-6-9-12-18-16(19)13-23-17(20)14-10-7-8-11-15(14)24(21,22)4-2/h7-8,10-11H,3-6,9,12-13H2,1-2H3,(H,18,19)