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

Systemtic Name: [2-[[2-butyl-6-(oxan-2-ylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[2-butyl-6-(tetrahydropyran-2-ylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-butyl-6-[[(2-oxanylamino)-oxomethyl]amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[2-butyl-6-(oxan-2-ylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[2-butyl-6-(tetrahydropyran-2-ylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C31H34N4O5 MolecularWeight: 542.62546

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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)NC5CCCCO5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=C(C=C2)NC(=O)NC5CCCCO5

InChI

InChI=1S/C31H34N4O5/c1-2-3-14-27-33-25-17-16-23(32-30(36)34-28-15-7-8-18-39-28)19-26(25)35(27)20-22-12-9-13-24(29(22)40-31(37)38)21-10-5-4-6-11-21/h4-6,9-13,16-17,19,28H,2-3,7-8,14-15,18,20H2,1H3,(H,37,38)(H2,32,34,36)