[(E)-4-[(4-methylphenyl)sulfonyl-prop-2-ynyl-amino]but-2-enyl] ethanoate

Systemtic Name: [(E)-4-[(4-methylphenyl)sulfonyl-prop-2-ynyl-amino]but-2-enyl] ethanoate Openeye Name: [(E)-4-[prop-2-ynyl(p-tolylsulfonyl)amino]but-2-enyl] acetate CAS Name: acetic acid [(E)-4-[(4-methylphenyl)sulfonyl-prop-2-ynylamino]but-2-enyl] ester IUPAC Name: [(E)-4-[(4-methylphenyl)sulfonyl-prop-2-ynylamino]but-2-enyl] acetate Traditional Name: acetic acid [(E)-4-[propargyl(tosyl)amino]but-2-enyl] ester Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC=CCOC(=O)C)CC#C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C/C=C/COC(=O)C)CC#C

InChI

InChI=1S/C16H19NO4S/c1-4-11-17(12-5-6-13-21-15(3)18)22(19,20)16-9-7-14(2)8-10-16/h1,5-10H,11-13H2,2-3H3/b6-5+