4-(quinolin-8-ylmethylamino)benzoic acid

Systemtic Name: 4-(quinolin-8-ylmethylamino)benzoic acid Openeye Name: 4-(8-quinolylmethylamino)benzoic acid CAS Name: 4-(8-quinolinylmethylamino)benzoic acid IUPAC Name: 4-(quinolin-8-ylmethylamino)benzoic acid Traditional Name: 4-(8-quinolylmethylamino)benzoic acid Formula: C17H14N2O2 MolecularWeight: 278.30526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CNC3=CC=C(C=C3)C(=O)O)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CNC3=CC=C(C=C3)C(=O)O)N=CC=C2

InChI

InChI=1S/C17H14N2O2/c20-17(21)13-6-8-15(9-7-13)19-11-14-4-1-3-12-5-2-10-18-16(12)14/h1-10,19H,11H2,(H,20,21)