prop-2-enyl 2-[[(3E)-2-methylideneocta-3,7-dienyl]-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: prop-2-enyl 2-[[(3E)-2-methylideneocta-3,7-dienyl]-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: allyl 2-[[(3E)-2-methyleneocta-3,7-dienyl]-(p-tolylsulfonyl)amino]acetate CAS Name: 2-[[(3E)-2-methyleneocta-3,7-dienyl]-(4-methylphenyl)sulfonylamino]acetic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[[(3E)-2-methylideneocta-3,7-dienyl]-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[[(3E)-2-methyleneocta-3,7-dienyl]-tosyl-amino]acetic acid allyl ester Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=C)C=CCCC=C)CC(=O)OCC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=C)/C=C/CCC=C)CC(=O)OCC=C

InChI

InChI=1S/C21H27NO4S/c1-5-7-8-9-10-19(4)16-22(17-21(23)26-15-6-2)27(24,25)20-13-11-18(3)12-14-20/h5-6,9-14H,1-2,4,7-8,15-17H2,3H3/b10-9+