[3-[6-[1-(cyclopropylmethyl)imidazol-4-yl]-2-ethoxy-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [3-[6-[1-(cyclopropylmethyl)imidazol-4-yl]-2-ethoxy-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [3-[6-[1-(cyclopropylmethyl)imidazol-4-yl]-2-ethoxy-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [3-[6-[1-(cyclopropylmethyl)-4-imidazolyl]-2-ethoxy-4-methyl-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: [3-[6-[1-(cyclopropylmethyl)imidazol-4-yl]-2-ethoxy-4-methylbenzimidazol-1-yl]-2-methyl-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [3-[6-[1-(cyclopropylmethyl)imidazol-4-yl]-2-ethoxy-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C31H30N4O4 MolecularWeight: 522.5943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C5=CN(C=N5)CC6CC6)C

Isomeric SMILES

CCOC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C5=CN(C=N5)CC6CC6)C

InChI

InChI=1S/C31H30N4O4/c1-4-38-30-33-28-19(2)14-23(25-17-34(18-32-25)16-21-10-11-21)15-27(28)35(30)26-13-12-24(22-8-6-5-7-9-22)29(20(26)3)39-31(36)37/h5-9,12-15,17-18,21H,4,10-11,16H2,1-3H3,(H,36,37)