tert-butyl [2-[(2-butyl-5-ethanoyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[(2-butyl-5-ethanoyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] carbonate Openeye Name: [2-[(5-acetyl-2-butyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] tert-butyl carbonate CAS Name: carbonic acid [2-[(5-acetyl-2-butyl-1-benzimidazolyl)methyl]-6-phenylphenyl] tert-butyl ester IUPAC Name: [2-[(5-acetyl-2-butylbenzimidazol-1-yl)methyl]-6-phenylphenyl] tert-butyl carbonate Traditional Name: carbonic acid [2-[(5-acetyl-2-butyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] tert-butyl ester Formula: C31H34N2O4 MolecularWeight: 498.61266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=CC(=C2)C(=O)C

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=CC(=C2)C(=O)C

InChI

InChI=1S/C31H34N2O4/c1-6-7-16-28-32-26-19-23(21(2)34)17-18-27(26)33(28)20-24-14-11-15-25(22-12-9-8-10-13-22)29(24)36-30(35)37-31(3,4)5/h8-15,17-19H,6-7,16,20H2,1-5H3