2-[[4-[(3-methyl-6-oxidanylidene-1H-pyridazin-5-yl)methyl]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(3-methyl-6-oxidanylidene-1H-pyridazin-5-yl)methyl]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(3-methyl-6-oxo-1H-pyridazin-5-yl)methyl]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[(3-methyl-6-oxo-1H-pyridazin-5-yl)methyl]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(3-methyl-6-oxo-1H-pyridazin-5-yl)methyl]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[(6-keto-3-methyl-1H-pyridazin-5-yl)methyl]phenyl]sulfonylamino]acetic acid Formula: C14H15N3O5S MolecularWeight: 337.351

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)C(=C1)CC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

Isomeric SMILES

CC1=NNC(=O)C(=C1)CC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C14H15N3O5S/c1-9-6-11(14(20)17-16-9)7-10-2-4-12(5-3-10)23(21,22)15-8-13(18)19/h2-6,15H,7-8H2,1H3,(H,17,20)(H,18,19)