[(Z)-3-(2-azanylbenzimidazol-1-yl)-1,4-dimethoxy-1-oxidanyl-4-oxidanylidene-but-1-en-2-yl]-triphenyl-phosphanium

Systemtic Name: [(Z)-3-(2-azanylbenzimidazol-1-yl)-1,4-dimethoxy-1-oxidanyl-4-oxidanylidene-but-1-en-2-yl]-triphenyl-phosphanium Openeye Name: [(1Z)-2-(2-aminobenzimidazol-1-yl)-1-[hydroxy(methoxy)methylene]-3-methoxy-3-oxo-propyl]-triphenyl-phosphonium CAS Name: [(Z)-3-(2-amino-1-benzimidazolyl)-1-hydroxy-1,4-dimethoxy-4-oxobut-1-en-2-yl]-triphenylphosphonium IUPAC Name: [(Z)-3-(2-aminobenzimidazol-1-yl)-1-hydroxy-1,4-dimethoxy-4-oxobut-1-en-2-yl]-triphenylphosphanium Traditional Name: [(Z)-1-[1-(2-aminobenzimidazol-1-yl)-2-keto-2-methoxy-ethyl]-2-hydroxy-2-methoxy-vinyl]-triphenyl-phosphonium Formula: C31H29N3O4P+ MolecularWeight: 538.553421

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=C(O)OC)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N4C5=CC=CC=C5N=C4N

Isomeric SMILES

COC(=O)C(/C(=C(\O)/OC)/[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N4C5=CC=CC=C5N=C4N

InChI

InChI=1S/C31H28N3O4P/c1-37-29(35)27(34-26-21-13-12-20-25(26)33-31(34)32)28(30(36)38-2)39(22-14-6-3-7-15-22,23-16-8-4-9-17-23)24-18-10-5-11-19-24/h3-21,27H,1-2H3,(H2-,32,33,36)/p+1/b30-28-