[3-[2-ethyl-6-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [3-[2-ethyl-6-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [3-[2-ethyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [3-[2-ethyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: [3-[2-ethyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]-2-methyl-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [3-[2-ethyl-6-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C=C(C=C2)C5=NNC(=O)CC5

Isomeric SMILES

CCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C=C(C=C2)C5=NNC(=O)CC5

InChI

InChI=1S/C27H24N4O4/c1-3-24-28-21-11-9-18(20-12-14-25(32)30-29-20)15-23(21)31(24)22-13-10-19(17-7-5-4-6-8-17)26(16(22)2)35-27(33)34/h4-11,13,15H,3,12,14H2,1-2H3,(H,30,32)(H,33,34)