methyl 2-[phenylsulfonyl(prop-2-ynyl)amino]-2-(trifluoromethyl)pent-4-ynoate

Systemtic Name: methyl 2-[phenylsulfonyl(prop-2-ynyl)amino]-2-(trifluoromethyl)pent-4-ynoate Openeye Name: methyl 2-[benzenesulfonyl(prop-2-ynyl)amino]-2-(trifluoromethyl)pent-4-ynoate CAS Name: 2-[benzenesulfonyl(prop-2-ynyl)amino]-2-(trifluoromethyl)-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[benzenesulfonyl(prop-2-ynyl)amino]-2-(trifluoromethyl)pent-4-ynoate Traditional Name: 2-[besyl(propargyl)amino]-2-(trifluoromethyl)pent-4-ynoic acid methyl ester Formula: C16H14F3NO4S MolecularWeight: 373.34687

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC#C)(C(F)(F)F)N(CC#C)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

COC(=O)C(CC#C)(C(F)(F)F)N(CC#C)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H14F3NO4S/c1-4-11-15(14(21)24-3,16(17,18)19)20(12-5-2)25(22,23)13-9-7-6-8-10-13/h1-2,6-10H,11-12H2,3H3