[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-(methylsulfinylmethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-(methylsulfinylmethyl)benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 3-(methylsulfinylmethyl)benzoate CAS Name: 3-(methylsulfinylmethyl)benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 3-(methylsulfinylmethyl)benzoate Traditional Name: 3-(methylsulfinylmethyl)benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC(=CC=C1)CS(=O)C

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC(=CC=C1)CS(=O)C

InChI

InChI=1S/C16H23NO4S/c1-4-14(5-2)17-15(18)10-21-16(19)13-8-6-7-12(9-13)11-22(3)20/h6-9,14H,4-5,10-11H2,1-3H3,(H,17,18)