methyl 5-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-2-ynoate

Systemtic Name: methyl 5-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-2-ynoate Openeye Name: methyl 5-[tert-butoxycarbonyl(p-tolylsulfonyl)amino]pent-2-ynoate CAS Name: 5-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pentynoic acid methyl ester IUPAC Name: methyl 5-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-2-ynoate Traditional Name: 5-[tert-butoxycarbonyl(tosyl)amino]pent-2-ynoic acid methyl ester Formula: C18H23NO6S MolecularWeight: 381.44332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC#CC(=O)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC#CC(=O)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H23NO6S/c1-14-9-11-15(12-10-14)26(22,23)19(17(21)25-18(2,3)4)13-7-6-8-16(20)24-5/h9-12H,7,13H2,1-5H3