(1E)-N-[(4-methylphenyl)-[(E,2S)-2-oxidanyl-4-phenyl-but-3-enyl]sulfonio]-1-phenylmethoxy-methanimidate

Systemtic Name: (1E)-N-[(4-methylphenyl)-[(E,2S)-2-oxidanyl-4-phenyl-but-3-enyl]sulfonio]-1-phenylmethoxy-methanimidate Openeye Name: (1E)-1-benzyloxy-N-[[(E,2S)-2-hydroxy-4-phenyl-but-3-enyl]-(p-tolyl)sulfonio]methanimidate CAS Name: (1E)-N-[[(E,2S)-2-hydroxy-4-phenylbut-3-enyl]-(4-methylphenyl)sulfonio]-1-phenylmethoxymethanimidate IUPAC Name: (1E)-N-[[(E,2S)-2-hydroxy-4-phenylbut-3-enyl]-(4-methylphenyl)sulfonio]-1-phenylmethoxymethanimidate Traditional Name: (1E)-1-benzoxy-N-[[(E,2S)-2-hydroxy-4-phenyl-but-3-enyl]-(p-tolyl)sulfonio]formimidate Formula: C25H25NO3S MolecularWeight: 419.5359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[S+](CC(C=CC2=CC=CC=C2)O)N=C([O-])OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)[S+](C[C@H](/C=C/C2=CC=CC=C2)O)/N=C(\[O-])/OCC3=CC=CC=C3

InChI

InChI=1S/C25H25NO3S/c1-20-12-16-24(17-13-20)30(19-23(27)15-14-21-8-4-2-5-9-21)26-25(28)29-18-22-10-6-3-7-11-22/h2-17,23,27H,18-19H2,1H3/b15-14+/t23-,30?/m0/s1