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

Systemtic Name: [2-[[2-butyl-6-(pentylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[2-butyl-6-(pentylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-butyl-6-(pentylamino)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[2-butyl-6-(pentylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[6-(amylamino)-2-butyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C30H35N3O3 MolecularWeight: 485.6172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=CC2=C(C=C1)N=C(N2CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)CCCC

Isomeric SMILES

CCCCCNC1=CC2=C(C=C1)N=C(N2CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)CCCC

InChI

InChI=1S/C30H35N3O3/c1-3-5-10-19-31-24-17-18-26-27(20-24)33(28(32-26)16-6-4-2)21-23-14-11-15-25(29(23)36-30(34)35)22-12-8-7-9-13-22/h7-9,11-15,17-18,20,31H,3-6,10,16,19,21H2,1-2H3,(H,34,35)