3-[6-[(phenylmethyl)amino]pyridazin-3-yl]benzoic acid

Systemtic Name: 3-[6-[(phenylmethyl)amino]pyridazin-3-yl]benzoic acid Openeye Name: 3-[6-(benzylamino)pyridazin-3-yl]benzoic acid CAS Name: 3-[6-[(phenylmethyl)amino]-3-pyridazinyl]benzoic acid IUPAC Name: 3-[6-(benzylamino)pyridazin-3-yl]benzoic acid Traditional Name: 3-[6-(benzylamino)pyridazin-3-yl]benzoic acid Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(C=C2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(C=C2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C18H15N3O2/c22-18(23)15-8-4-7-14(11-15)16-9-10-17(21-20-16)19-12-13-5-2-1-3-6-13/h1-11H,12H2,(H,19,21)(H,22,23)