2-[5-chloranyl-4-[(3,4-dimethoxyphenyl)methylamino]-6-oxidanylidene-pyridazin-1-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-4-[(3,4-dimethoxyphenyl)methylamino]-6-oxidanylidene-pyridazin-1-yl]ethanoic acid Openeye Name: 2-[5-chloro-4-[(3,4-dimethoxyphenyl)methylamino]-6-oxo-pyridazin-1-yl]acetic acid CAS Name: 2-[5-chloro-4-[(3,4-dimethoxyphenyl)methylamino]-6-oxo-1-pyridazinyl]acetic acid IUPAC Name: 2-[5-chloro-4-[(3,4-dimethoxyphenyl)methylamino]-6-oxopyridazin-1-yl]acetic acid Traditional Name: 2-[5-chloro-6-keto-4-(veratrylamino)pyridazin-1-yl]acetic acid Formula: C15H16ClN3O5 MolecularWeight: 353.75764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C(=O)N(N=C2)CC(=O)O)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C(=O)N(N=C2)CC(=O)O)Cl)OC

InChI

InChI=1S/C15H16ClN3O5/c1-23-11-4-3-9(5-12(11)24-2)6-17-10-7-18-19(8-13(20)21)15(22)14(10)16/h3-5,7,17H,6,8H2,1-2H3,(H,20,21)