6-[(1,2-diphenylbenzimidazol-5-yl)-(1-methoxy-1-oxidanylidene-hexan-2-yl)amino]hexanoic acid

Systemtic Name: 6-[(1,2-diphenylbenzimidazol-5-yl)-(1-methoxy-1-oxidanylidene-hexan-2-yl)amino]hexanoic acid Openeye Name: 6-[(1,2-diphenylbenzimidazol-5-yl)-(1-methoxycarbonylpentyl)amino]hexanoic acid CAS Name: 6-[(1,2-diphenyl-5-benzimidazolyl)-(1-methoxy-1-oxohexan-2-yl)amino]hexanoic acid IUPAC Name: 6-[(1,2-diphenylbenzimidazol-5-yl)-(1-methoxy-1-oxohexan-2-yl)amino]hexanoic acid Traditional Name: 6-[1-carbomethoxypentyl-(1,2-diphenylbenzimidazol-5-yl)amino]hexanoic acid Formula: C32H37N3O4 MolecularWeight: 527.65388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)N(CCCCCC(=O)O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCC(C(=O)OC)N(CCCCCC(=O)O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H37N3O4/c1-3-4-18-29(32(38)39-2)34(22-13-7-12-19-30(36)37)26-20-21-28-27(23-26)33-31(24-14-8-5-9-15-24)35(28)25-16-10-6-11-17-25/h5-6,8-11,14-17,20-21,23,29H,3-4,7,12-13,18-19,22H2,1-2H3,(H,36,37)