6-[3-(3-methoxypropyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid; N-methylmethanamine

Systemtic Name: 6-[3-(3-methoxypropyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid; N-methylmethanamine Openeye Name: 6-[3-(3-methoxypropyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid; N-methylmethanamine CAS Name: 6-[[3-(3-methoxypropyl)-2-phenyl-5-benzimidazolyl]oxy]hexanoic acid; N-methylmethanamine IUPAC Name: 6-[3-(3-methoxypropyl)-2-phenylbenzimidazol-5-yl]oxyhexanoic acid; N-methylmethanamine Traditional Name: dimethylamine; 6-[3-(3-methoxypropyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid Formula: C25H35N3O4 MolecularWeight: 441.5631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC.COCCCN1C2=C(C=CC(=C2)OCCCCCC(=O)O)N=C1C3=CC=CC=C3

Isomeric SMILES

CNC.COCCCN1C2=C(C=CC(=C2)OCCCCCC(=O)O)N=C1C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O4.C2H7N/c1-28-15-8-14-25-21-17-19(29-16-7-3-6-11-22(26)27)12-13-20(21)24-23(25)18-9-4-2-5-10-18;1-3-2/h2,4-5,9-10,12-13,17H,3,6-8,11,14-16H2,1H3,(H,26,27);3H,1-2H3