2-[5-[3-(diphenylmethyl)oxypropylsulfanyl-oxidanyl-methyl]naphthalen-1-yl]oxyethanenitrile

Systemtic Name: 2-[5-[3-(diphenylmethyl)oxypropylsulfanyl-oxidanyl-methyl]naphthalen-1-yl]oxyethanenitrile Openeye Name: 2-[[5-[3-benzhydryloxypropylsulfanyl(hydroxy)methyl]-1-naphthyl]oxy]acetonitrile CAS Name: 2-[[5-[[3-(diphenylmethyl)oxypropylthio]-hydroxymethyl]-1-naphthalenyl]oxy]acetonitrile IUPAC Name: 2-[5-[3-benzhydryloxypropylsulfanyl(hydroxy)methyl]naphthalen-1-yl]oxyacetonitrile Traditional Name: 2-[5-[(3-benzhydryloxypropylthio)-hydroxy-methyl]-1-naphthoxy]acetonitrile Formula: C29H27NO3S MolecularWeight: 469.59458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OCCCSC(C3=CC=CC4=C3C=CC=C4OCC#N)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OCCCSC(C3=CC=CC4=C3C=CC=C4OCC#N)O

InChI

InChI=1S/C29H27NO3S/c30-18-20-32-27-17-8-14-24-25(27)15-7-16-26(24)29(31)34-21-9-19-33-28(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-17,28-29,31H,9,19-21H2