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

Systemtic Name: [2-[(6-acetamido-2-butyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] tert-butyl carbonate Openeye Name: [2-[(6-acetamido-2-butyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] tert-butyl carbonate CAS Name: carbonic acid [2-[(6-acetamido-2-butyl-1-benzimidazolyl)methyl]-6-phenylphenyl] tert-butyl ester IUPAC Name: [2-[(6-acetamido-2-butylbenzimidazol-1-yl)methyl]-6-phenylphenyl] tert-butyl carbonate Traditional Name: carbonic acid [2-[(6-acetamido-2-butyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] tert-butyl ester Formula: C31H35N3O4 MolecularWeight: 513.6273

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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=C(C=C2)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C31H35N3O4/c1-6-7-16-28-33-26-18-17-24(32-21(2)35)19-27(26)34(28)20-23-14-11-15-25(22-12-9-8-10-13-22)29(23)37-30(36)38-31(3,4)5/h8-15,17-19H,6-7,16,20H2,1-5H3,(H,32,35)