[2-[[2-butyl-6-(cyclopentylcarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[[2-butyl-6-(cyclopentylcarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[2-butyl-6-(cyclopentanecarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-butyl-6-[[cyclopentyl(oxo)methyl]amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[2-butyl-6-(cyclopentanecarbonylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[2-butyl-6-(cyclopentanecarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C31H33N3O4 MolecularWeight: 511.61142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=C(C=C2)NC(=O)C5CCCC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=C(C=C2)NC(=O)C5CCCC5

InChI

InChI=1S/C31H33N3O4/c1-2-3-16-28-33-26-18-17-24(32-30(35)22-12-7-8-13-22)19-27(26)34(28)20-23-14-9-15-25(29(23)38-31(36)37)21-10-5-4-6-11-21/h4-6,9-11,14-15,17-19,22H,2-3,7-8,12-13,16,20H2,1H3,(H,32,35)(H,36,37)