1-[2-[3-(5,6-dimethylbenzimidazol-1-yl)propoxy]phenyl]propan-1-one; ethanedioic acid

Systemtic Name: 1-[2-[3-(5,6-dimethylbenzimidazol-1-yl)propoxy]phenyl]propan-1-one; ethanedioic acid Openeye Name: 1-[2-[3-(5,6-dimethylbenzimidazol-1-yl)propoxy]phenyl]propan-1-one; oxalic acid CAS Name: 1-[2-[3-(5,6-dimethyl-1-benzimidazolyl)propoxy]phenyl]-1-propanone; oxalic acid IUPAC Name: 1-[2-[3-(5,6-dimethylbenzimidazol-1-yl)propoxy]phenyl]propan-1-one; oxalic acid Traditional Name: 1-[2-[3-(5,6-dimethylbenzimidazol-1-yl)propoxy]phenyl]propan-1-one; oxalic acid Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC=C1OCCCN2C=NC3=C2C=C(C(=C3)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(=O)C1=CC=CC=C1OCCCN2C=NC3=C2C=C(C(=C3)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H24N2O2.C2H2O4/c1-4-20(24)17-8-5-6-9-21(17)25-11-7-10-23-14-22-18-12-15(2)16(3)13-19(18)23;3-1(4)2(5)6/h5-6,8-9,12-14H,4,7,10-11H2,1-3H3;(H,3,4)(H,5,6)