3-(4-aminocarbonyl-1,3-dimethyl-pyrido[1,2-a]benzimidazol-2-yl)propanoic acid

Systemtic Name: 3-(4-aminocarbonyl-1,3-dimethyl-pyrido[1,2-a]benzimidazol-2-yl)propanoic acid Openeye Name: 3-(4-carbamoyl-1,3-dimethyl-pyrido[1,2-a]benzimidazol-2-yl)propanoic acid CAS Name: 3-(4-carbamoyl-1,3-dimethyl-2-pyrido[1,2-a]benzimidazolyl)propanoic acid IUPAC Name: 3-(4-carbamoyl-1,3-dimethylpyrido[1,2-a]benzimidazol-2-yl)propanoic acid Traditional Name: 3-(4-carbamoyl-1,3-dimethyl-pyrido[1,2-a]benzimidazol-2-yl)propionic acid Formula: C17H17N3O3 MolecularWeight: 311.33518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)O)C)C(=O)N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)O)C)C(=O)N

InChI

InChI=1S/C17H17N3O3/c1-9-11(7-8-14(21)22)10(2)20-13-6-4-3-5-12(13)19-17(20)15(9)16(18)23/h3-6H,7-8H2,1-2H3,(H2,18,23)(H,21,22)