2-ethyl-2-[ethyl-[(E)-3-(phenylsulfonyl)prop-2-enoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: 2-ethyl-2-[ethyl-[(E)-3-(phenylsulfonyl)prop-2-enoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoate Openeye Name: 2-[[(E)-3-(benzenesulfonyl)prop-2-enoyl]-ethyl-amino]-2-ethyl-4-hydroxy-4-oxo-butanoate CAS Name: 2-[[(E)-3-(benzenesulfonyl)-1-oxoprop-2-enyl]-ethylamino]-2-ethyl-4-hydroxy-4-oxobutanoate IUPAC Name: 2-[[(E)-3-(benzenesulfonyl)prop-2-enoyl]-ethylamino]-2-ethyl-4-hydroxy-4-oxobutanoate Traditional Name: 2-[[(E)-3-besylacryloyl]-ethyl-amino]-2-ethyl-4-hydroxy-4-keto-butyrate Formula: C17H20NO7S- MolecularWeight: 382.4082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)O)(C(=O)[O-])N(CC)C(=O)C=CS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCC(CC(=O)O)(C(=O)[O-])N(CC)C(=O)/C=C/S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H21NO7S/c1-3-17(16(22)23,12-15(20)21)18(4-2)14(19)10-11-26(24,25)13-8-6-5-7-9-13/h5-11H,3-4,12H2,1-2H3,(H,20,21)(H,22,23)/p-1/b11-10+