ethyl (E)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-[(triphenylmethyl)amino]hex-1-ene-1-sulfonate

Systemtic Name: ethyl (E)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-[(triphenylmethyl)amino]hex-1-ene-1-sulfonate Openeye Name: ethyl (E)-3-(tert-butoxycarbonylamino)-6-oxo-6-(tritylamino)hex-1-ene-1-sulfonate CAS Name: (E)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxo-6-[(triphenylmethyl)amino]-1-hexene-1-sulfonic acid ethyl ester IUPAC Name: ethyl (E)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-6-(tritylamino)hex-1-ene-1-sulfonate Traditional Name: (E)-3-(tert-butoxycarbonylamino)-6-keto-6-(tritylamino)hex-1-ene-1-sulfonic acid ethyl ester Formula: C32H38N2O6S MolecularWeight: 578.71892

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)C=CC(CCC(=O)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOS(=O)(=O)/C=C/C(CCC(=O)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C32H38N2O6S/c1-5-39-41(37,38)24-23-28(33-30(36)40-31(2,3)4)21-22-29(35)34-32(25-15-9-6-10-16-25,26-17-11-7-12-18-26)27-19-13-8-14-20-27/h6-20,23-24,28H,5,21-22H2,1-4H3,(H,33,36)(H,34,35)/b24-23+