(2-methoxyphenyl) 2-butyl-4-heptan-2-yloxy-1-(4-methoxyphenyl)benzimidazole-5-carboxylate

Systemtic Name: (2-methoxyphenyl) 2-butyl-4-heptan-2-yloxy-1-(4-methoxyphenyl)benzimidazole-5-carboxylate Openeye Name: (2-methoxyphenyl) 2-butyl-1-(4-methoxyphenyl)-4-(1-methylhexoxy)benzimidazole-5-carboxylate CAS Name: 2-butyl-4-heptan-2-yloxy-1-(4-methoxyphenyl)-5-benzimidazolecarboxylic acid (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) 2-butyl-4-heptan-2-yloxy-1-(4-methoxyphenyl)benzimidazole-5-carboxylate Traditional Name: 2-butyl-1-(4-methoxyphenyl)-4-(1-methylhexoxy)benzimidazole-5-carboxylic acid (2-methoxyphenyl) ester Formula: C33H40N2O5 MolecularWeight: 544.6811

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)OC1=C(C=CC2=C1N=C(N2C3=CC=C(C=C3)OC)CCCC)C(=O)OC4=CC=CC=C4OC

Isomeric SMILES

CCCCCC(C)OC1=C(C=CC2=C1N=C(N2C3=CC=C(C=C3)OC)CCCC)C(=O)OC4=CC=CC=C4OC

InChI

InChI=1S/C33H40N2O5/c1-6-8-10-13-23(3)39-32-26(33(36)40-29-15-12-11-14-28(29)38-5)21-22-27-31(32)34-30(16-9-7-2)35(27)24-17-19-25(37-4)20-18-24/h11-12,14-15,17-23H,6-10,13,16H2,1-5H3