3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]-3-ethoxy-propanoic acid

Systemtic Name: 3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]-3-ethoxy-propanoic acid Openeye Name: 3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxo-benzimidazol-1-yl]-3-ethoxy-propanoic acid CAS Name: 3-[3-[(1,4-dimethyl-3-indolyl)methyl]-2-oxo-1-benzimidazolyl]-3-ethoxypropanoic acid IUPAC Name: 3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxobenzimidazol-1-yl]-3-ethoxypropanoic acid Traditional Name: 3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-keto-benzimidazol-1-yl]-3-ethoxy-propionic acid Formula: C23H25N3O4 MolecularWeight: 407.4623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(=O)O)N1C2=CC=CC=C2N(C1=O)CC3=CN(C4=CC=CC(=C43)C)C

Isomeric SMILES

CCOC(CC(=O)O)N1C2=CC=CC=C2N(C1=O)CC3=CN(C4=CC=CC(=C43)C)C

InChI

InChI=1S/C23H25N3O4/c1-4-30-20(12-21(27)28)26-18-10-6-5-9-17(18)25(23(26)29)14-16-13-24(3)19-11-7-8-15(2)22(16)19/h5-11,13,20H,4,12,14H2,1-3H3,(H,27,28)