ethyl 2-methyl-5-[3-(2-methylbenzimidazol-1-yl)-2-oxidanyl-propoxy]-1-(phenylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-[3-(2-methylbenzimidazol-1-yl)-2-oxidanyl-propoxy]-1-(phenylmethyl)indole-3-carboxylate Openeye Name: ethyl 1-benzyl-5-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propoxy]-2-methyl-indole-3-carboxylate CAS Name: 5-[2-hydroxy-3-(2-methyl-1-benzimidazolyl)propoxy]-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propoxy]-2-methylindole-3-carboxylate Traditional Name: 1-benzyl-5-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propoxy]-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3C(=NC4=CC=CC=C43)C)O)CC5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3C(=NC4=CC=CC=C43)C)O)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H31N3O4/c1-4-36-30(35)29-20(2)32(17-22-10-6-5-7-11-22)27-15-14-24(16-25(27)29)37-19-23(34)18-33-21(3)31-26-12-8-9-13-28(26)33/h5-16,23,34H,4,17-19H2,1-3H3