methyl 3-[[(E)-3-oxidanyl-5-(phenylsulfonyl)pent-4-enyl]amino]propanoate

Systemtic Name: methyl 3-[[(E)-3-oxidanyl-5-(phenylsulfonyl)pent-4-enyl]amino]propanoate Openeye Name: methyl 3-[[(E)-5-(benzenesulfonyl)-3-hydroxy-pent-4-enyl]amino]propanoate CAS Name: 3-[[(E)-5-(benzenesulfonyl)-3-hydroxypent-4-enyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[(E)-5-(benzenesulfonyl)-3-hydroxypent-4-enyl]amino]propanoate Traditional Name: 3-[[(E)-5-besyl-3-hydroxy-pent-4-enyl]amino]propionic acid methyl ester Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNCCC(C=CS(=O)(=O)C1=CC=CC=C1)O

Isomeric SMILES

COC(=O)CCNCCC(/C=C/S(=O)(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C15H21NO5S/c1-21-15(18)8-11-16-10-7-13(17)9-12-22(19,20)14-5-3-2-4-6-14/h2-6,9,12-13,16-17H,7-8,10-11H2,1H3/b12-9+