4-chloranyl-3-[(2Z)-2-[4-methanoyl-6-methyl-5-oxidanylidene-3-(phosphonomethyl)pyridin-2-ylidene]hydrazinyl]benzenesulfonic acid

Systemtic Name: 4-chloranyl-3-[(2Z)-2-[4-methanoyl-6-methyl-5-oxidanylidene-3-(phosphonomethyl)pyridin-2-ylidene]hydrazinyl]benzenesulfonic acid Openeye Name: 4-chloro-3-[(2Z)-2-[4-formyl-6-methyl-5-oxo-3-(phosphonomethyl)-2-pyridylidene]hydrazino]benzenesulfonic acid CAS Name: 4-chloro-3-[(2Z)-2-[4-formyl-6-methyl-5-oxo-3-(phosphonomethyl)-2-pyridinylidene]hydrazinyl]benzenesulfonic acid IUPAC Name: 4-chloro-3-[(2Z)-2-[4-formyl-6-methyl-5-oxo-3-(phosphonomethyl)pyridin-2-ylidene]hydrazinyl]benzenesulfonic acid Traditional Name: 4-chloro-3-[(N'Z)-N'-[4-formyl-5-keto-6-methyl-3-(phosphonomethyl)-2-pyridylidene]hydrazino]besylic acid Formula: C14H13ClN3O8PS MolecularWeight: 449.760081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NNC2=C(C=CC(=C2)S(=O)(=O)O)Cl)C(=C(C1=O)C=O)CP(=O)(O)O

Isomeric SMILES

CC1=N/C(=N\NC2=C(C=CC(=C2)S(=O)(=O)O)Cl)/C(=C(C1=O)C=O)CP(=O)(O)O

InChI

InChI=1S/C14H13ClN3O8PS/c1-7-13(20)9(5-19)10(6-27(21,22)23)14(16-7)18-17-12-4-8(28(24,25)26)2-3-11(12)15/h2-5,17H,6H2,1H3,(H2,21,22,23)(H,24,25,26)/b18-14-