ethanedioic acid; 1-[4-(2-methyl-5-propan-2-yl-phenoxy)butyl]benzimidazole

Systemtic Name: ethanedioic acid; 1-[4-(2-methyl-5-propan-2-yl-phenoxy)butyl]benzimidazole Openeye Name: 1-[4-(5-isopropyl-2-methyl-phenoxy)butyl]benzimidazole; oxalic acid CAS Name: 1-[4-(2-methyl-5-propan-2-ylphenoxy)butyl]benzimidazole; oxalic acid IUPAC Name: 1-[4-(2-methyl-5-propan-2-ylphenoxy)butyl]benzimidazole; oxalic acid Traditional Name: 1-[4-(5-isopropyl-2-methyl-phenoxy)butyl]benzimidazole; oxalic acid Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C)OCCCCN2C=NC3=CC=CC=C32.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C)OCCCCN2C=NC3=CC=CC=C32.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H26N2O.C2H2O4/c1-16(2)18-11-10-17(3)21(14-18)24-13-7-6-12-23-15-22-19-8-4-5-9-20(19)23;3-1(4)2(5)6/h4-5,8-11,14-16H,6-7,12-13H2,1-3H3;(H,3,4)(H,5,6)