3-[6-oxidanylidene-1-(phenylmethyl)pyridazin-3-yl]propanoic acid

Systemtic Name: 3-[6-oxidanylidene-1-(phenylmethyl)pyridazin-3-yl]propanoic acid Openeye Name: 3-(1-benzyl-6-oxo-pyridazin-3-yl)propanoic acid CAS Name: 3-[6-oxo-1-(phenylmethyl)-3-pyridazinyl]propanoic acid IUPAC Name: 3-(1-benzyl-6-oxopyridazin-3-yl)propanoic acid Traditional Name: 3-(1-benzyl-6-keto-pyridazin-3-yl)propionic acid Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C=CC(=N2)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C=CC(=N2)CCC(=O)O

InChI

InChI=1S/C14H14N2O3/c17-13-8-6-12(7-9-14(18)19)15-16(13)10-11-4-2-1-3-5-11/h1-6,8H,7,9-10H2,(H,18,19)