ethyl 5-[3-(4,5-diphenylimidazol-1-yl)-2-oxidanyl-propoxy]-2-methyl-1-(4-methylphenyl)indole-3-carboxylate

Systemtic Name: ethyl 5-[3-(4,5-diphenylimidazol-1-yl)-2-oxidanyl-propoxy]-2-methyl-1-(4-methylphenyl)indole-3-carboxylate Openeye Name: ethyl 5-[3-(4,5-diphenylimidazol-1-yl)-2-hydroxy-propoxy]-2-methyl-1-(p-tolyl)indole-3-carboxylate CAS Name: 5-[3-(4,5-diphenyl-1-imidazolyl)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4,5-diphenylimidazol-1-yl)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)indole-3-carboxylate Traditional Name: 5-[3-(4,5-diphenylimidazol-1-yl)-2-hydroxy-propoxy]-2-methyl-1-(p-tolyl)indole-3-carboxylic acid ethyl ester Formula: C37H35N3O4 MolecularWeight: 585.6915

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3C=NC(=C3C4=CC=CC=C4)C5=CC=CC=C5)O)C6=CC=C(C=C6)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3C=NC(=C3C4=CC=CC=C4)C5=CC=CC=C5)O)C6=CC=C(C=C6)C)C

InChI

InChI=1S/C37H35N3O4/c1-4-43-37(42)34-26(3)40(29-17-15-25(2)16-18-29)33-20-19-31(21-32(33)34)44-23-30(41)22-39-24-38-35(27-11-7-5-8-12-27)36(39)28-13-9-6-10-14-28/h5-21,24,30,41H,4,22-23H2,1-3H3