3-[[2-[(1S)-1-azanylethyl]benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[2-[(1S)-1-azanylethyl]benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 3-[[2-[(1S)-1-aminoethyl]benzimidazol-1-yl]methyl]benzoic acid CAS Name: 3-[[2-[(1S)-1-aminoethyl]-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 3-[[2-[(1S)-1-aminoethyl]benzimidazol-1-yl]methyl]benzoic acid Traditional Name: 3-[[2-[(1S)-1-aminoethyl]benzimidazol-1-yl]methyl]benzoic acid Formula: C17H17N3O2 MolecularWeight: 295.33578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1CC3=CC=CC(=C3)C(=O)O)N

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2N1CC3=CC=CC(=C3)C(=O)O)N

InChI

InChI=1S/C17H17N3O2/c1-11(18)16-19-14-7-2-3-8-15(14)20(16)10-12-5-4-6-13(9-12)17(21)22/h2-9,11H,10,18H2,1H3,(H,21,22)/t11-/m0/s1