ethyl 2-methyl-3-[4-[2-[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]ethoxy]phenyl]-2-phenoxy-propanoate

Systemtic Name: ethyl 2-methyl-3-[4-[2-[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]ethoxy]phenyl]-2-phenoxy-propanoate Openeye Name: ethyl 2-methyl-3-[4-[2-[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]ethoxy]phenyl]-2-phenoxy-propanoate CAS Name: 2-methyl-3-[4-[2-[4-methyl-6-(1-methyl-2-benzimidazolyl)-2-propyl-1-benzimidazolyl]ethoxy]phenyl]-2-phenoxypropanoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-[4-[2-[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]ethoxy]phenyl]-2-phenoxypropanoate Traditional Name: 2-methyl-3-[4-[2-[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]ethoxy]phenyl]-2-phenoxy-propionic acid ethyl ester Formula: C39H42N4O4 MolecularWeight: 630.77518

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1CCOC3=CC=C(C=C3)CC(C)(C(=O)OCC)OC4=CC=CC=C4)C5=NC6=CC=CC=C6N5C)C

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1CCOC3=CC=C(C=C3)CC(C)(C(=O)OCC)OC4=CC=CC=C4)C5=NC6=CC=CC=C6N5C)C

InChI

InChI=1S/C39H42N4O4/c1-6-13-35-41-36-27(3)24-29(37-40-32-16-11-12-17-33(32)42(37)5)25-34(36)43(35)22-23-46-30-20-18-28(19-21-30)26-39(4,38(44)45-7-2)47-31-14-9-8-10-15-31/h8-12,14-21,24-25H,6-7,13,22-23,26H2,1-5H3