4-[[5-ethoxy-3-oxidanylidene-2-(phenylmethyl)pyridazin-4-yl]amino]benzoic acid

Systemtic Name: 4-[[5-ethoxy-3-oxidanylidene-2-(phenylmethyl)pyridazin-4-yl]amino]benzoic acid Openeye Name: 4-[(2-benzyl-5-ethoxy-3-oxo-pyridazin-4-yl)amino]benzoic acid CAS Name: 4-[[5-ethoxy-3-oxo-2-(phenylmethyl)-4-pyridazinyl]amino]benzoic acid IUPAC Name: 4-[(2-benzyl-5-ethoxy-3-oxopyridazin-4-yl)amino]benzoic acid Traditional Name: 4-[(2-benzyl-5-ethoxy-3-keto-pyridazin-4-yl)amino]benzoic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)N(N=C1)CC2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCOC1=C(C(=O)N(N=C1)CC2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H19N3O4/c1-2-27-17-12-21-23(13-14-6-4-3-5-7-14)19(24)18(17)22-16-10-8-15(9-11-16)20(25)26/h3-12,22H,2,13H2,1H3,(H,25,26)