4-(aminomethyl)benzoic acid; 1H-benzimidazol-2-ylmethanamine

Systemtic Name: 4-(aminomethyl)benzoic acid; 1H-benzimidazol-2-ylmethanamine Openeye Name: 4-(aminomethyl)benzoic acid; 1H-benzimidazol-2-ylmethanamine CAS Name: 4-(aminomethyl)benzoic acid; 1H-benzimidazol-2-ylmethanamine IUPAC Name: 4-(aminomethyl)benzoic acid; 1H-benzimidazol-2-ylmethanamine Traditional Name: 4-(aminomethyl)benzoic acid; 1H-benzimidazol-2-ylmethylamine Formula: C16H18N4O2 MolecularWeight: 298.33972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CN.C1=CC(=CC=C1CN)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CN.C1=CC(=CC=C1CN)C(=O)O

InChI

InChI=1S/C8H9N3.C8H9NO2/c9-5-8-10-6-3-1-2-4-7(6)11-8;9-5-6-1-3-7(4-2-6)8(10)11/h2*1-4H,5,9H2,(H,10,11)