ethyl 4-[(3-ethylsulfonyloxyphenyl)methyl-propan-2-yl-amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(3-ethylsulfonyloxyphenyl)methyl-propan-2-yl-amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[(3-ethylsulfonyloxyphenyl)methyl-isopropyl-amino]-4-oxo-butanoate CAS Name: 4-[(3-ethylsulfonyloxyphenyl)methyl-propan-2-ylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(3-ethylsulfonyloxyphenyl)methyl-propan-2-ylamino]-4-oxobutanoate Traditional Name: 4-[(3-esyloxybenzyl)-isopropyl-amino]-4-keto-butyric acid ethyl ester Formula: C18H27NO6S MolecularWeight: 385.47508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CC1=CC(=CC=C1)OS(=O)(=O)CC)C(C)C

Isomeric SMILES

CCOC(=O)CCC(=O)N(CC1=CC(=CC=C1)OS(=O)(=O)CC)C(C)C

InChI

InChI=1S/C18H27NO6S/c1-5-24-18(21)11-10-17(20)19(14(3)4)13-15-8-7-9-16(12-15)25-26(22,23)6-2/h7-9,12,14H,5-6,10-11,13H2,1-4H3