2-[(4-azido-3-chloranyl-phenyl)methoxymethyl]-3,4,5-tris(phenylmethoxy)-6-phenylsulfanyl-oxane

Systemtic Name: 2-[(4-azido-3-chloranyl-phenyl)methoxymethyl]-3,4,5-tris(phenylmethoxy)-6-phenylsulfanyl-oxane Openeye Name: 2-[(4-azido-3-chloro-phenyl)methoxymethyl]-3,4,5-tribenzyloxy-6-phenylsulfanyl-tetrahydropyran CAS Name: 2-[(4-azido-3-chlorophenyl)methoxymethyl]-3,4,5-tris(phenylmethoxy)-6-(phenylthio)oxane IUPAC Name: 2-[(4-azido-3-chlorophenyl)methoxymethyl]-3,4,5-tris(phenylmethoxy)-6-phenylsulfanyloxane Traditional Name: 2-[(4-azido-3-chloro-benzyl)oxymethyl]-3,4,5-tribenzoxy-6-(phenylthio)tetrahydropyran Formula: C40H38ClN3O5S MolecularWeight: 708.26482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2C(OC(C(C2OCC3=CC=CC=C3)OCC4=CC=CC=C4)SC5=CC=CC=C5)COCC6=CC(=C(C=C6)N=[N+]=[N-])Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2C(OC(C(C2OCC3=CC=CC=C3)OCC4=CC=CC=C4)SC5=CC=CC=C5)COCC6=CC(=C(C=C6)N=[N+]=[N-])Cl

InChI

InChI=1S/C40H38ClN3O5S/c41-34-23-32(21-22-35(34)43-44-42)24-45-28-36-37(46-25-29-13-5-1-6-14-29)38(47-26-30-15-7-2-8-16-30)39(48-27-31-17-9-3-10-18-31)40(49-36)50-33-19-11-4-12-20-33/h1-23,36-40H,24-28H2