methyl (E)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenyl-but-1-ene-1-sulfonate

Systemtic Name: methyl (E)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenyl-but-1-ene-1-sulfonate Openeye Name: methyl (E)-3-(tert-butoxycarbonylamino)-4-phenyl-but-1-ene-1-sulfonate CAS Name: (E)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-phenyl-1-butene-1-sulfonic acid methyl ester IUPAC Name: methyl (E)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylbut-1-ene-1-sulfonate Traditional Name: (E)-3-(tert-butoxycarbonylamino)-4-phenyl-but-1-ene-1-sulfonic acid methyl ester Formula: C16H23NO5S MolecularWeight: 341.42252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C=CS(=O)(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)/C=C/S(=O)(=O)OC

InChI

InChI=1S/C16H23NO5S/c1-16(2,3)22-15(18)17-14(10-11-23(19,20)21-4)12-13-8-6-5-7-9-13/h5-11,14H,12H2,1-4H3,(H,17,18)/b11-10+