ethanedioic acid; 1-[3-(2-methyl-5-propan-2-yl-phenoxy)propyl]benzimidazole

Systemtic Name: ethanedioic acid; 1-[3-(2-methyl-5-propan-2-yl-phenoxy)propyl]benzimidazole Openeye Name: 1-[3-(5-isopropyl-2-methyl-phenoxy)propyl]benzimidazole; oxalic acid CAS Name: 1-[3-(2-methyl-5-propan-2-ylphenoxy)propyl]benzimidazole; oxalic acid IUPAC Name: 1-[3-(2-methyl-5-propan-2-ylphenoxy)propyl]benzimidazole; oxalic acid Traditional Name: 1-[3-(5-isopropyl-2-methyl-phenoxy)propyl]benzimidazole; oxalic acid Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C)OCCCN2C=NC3=CC=CC=C32.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C)OCCCN2C=NC3=CC=CC=C32.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H24N2O.C2H2O4/c1-15(2)17-10-9-16(3)20(13-17)23-12-6-11-22-14-21-18-7-4-5-8-19(18)22;3-1(4)2(5)6/h4-5,7-10,13-15H,6,11-12H2,1-3H3;(H,3,4)(H,5,6)