tert-butyl [2-[[2-(3-oxidanylpropyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[[2-(3-oxidanylpropyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-(3-hydroxypropyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-(3-hydroxypropyl)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-(3-hydroxypropyl)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-(3-hydroxypropyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=C(C=CC=C1CN2C3=CC=CC=C3N=C2CCCO)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)OC1=C(C=CC=C1CN2C3=CC=CC=C3N=C2CCCO)C4=CC=CC=C4

InChI

InChI=1S/C28H30N2O4/c1-28(2,3)34-27(32)33-26-21(13-9-14-22(26)20-11-5-4-6-12-20)19-30-24-16-8-7-15-23(24)29-25(30)17-10-18-31/h4-9,11-16,31H,10,17-19H2,1-3H3