[3-[2-butyl-6-[(4-phenylphenyl)carbonylamino]benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [3-[2-butyl-6-[(4-phenylphenyl)carbonylamino]benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [3-[2-butyl-6-[(4-phenylbenzoyl)amino]benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [3-[2-butyl-6-[[oxo-(4-phenylphenyl)methyl]amino]-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: [3-[2-butyl-6-[(4-phenylbenzoyl)amino]benzimidazol-1-yl]-2-methyl-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [3-[2-butyl-6-[(4-phenylbenzoyl)amino]benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C38H33N3O4 MolecularWeight: 595.68632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C=C(C=C2)NC(=O)C5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C=C(C=C2)NC(=O)C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H33N3O4/c1-3-4-15-35-40-32-22-20-30(39-37(42)29-18-16-27(17-19-29)26-11-7-5-8-12-26)24-34(32)41(35)33-23-21-31(28-13-9-6-10-14-28)36(25(33)2)45-38(43)44/h5-14,16-24H,3-4,15H2,1-2H3,(H,39,42)(H,43,44)