HIT ID: HIT218847647
Cas No: 6359-95-1
分子式: C20H15ClN4Na2O7S2
分子量: 568.91
常用名: C.I. Acid yellow 200
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: disodium (4-chloro-3-{3-methyl-5-oxo-4-[(1E)-2-(1-sulfonatonaphthalen-2-yl)diazen-1-yl]-4,5-dihydro-1H-pyrazol-1-yl}phenyl)(hydroxy)dioxo-lambda6-sulfanuide
IUPAC: disodium (4-chloro-3-{3-methyl-5-oxo-4-[(1E)-2-(1-sulfonatonaphthalen-2-yl)diazen-1-yl]-4,5-dihydro-1H-pyrazol-1-yl}phenyl)(hydroxy)dioxo-lambda6-sulfanuide
SMILES: [Na+].[Na+].CC1=NN(C(=O)C1\N=N\c1ccc2ccccc2c1S([O-])(=O)=O)c1cc(ccc1Cl)[SH-](O)(=O)=O
SMILES: [Na+].[Na+].CC1=NN(C(=O)C1\N=N\c1ccc2ccccc2c1S([O-])(=O)=O)c1cc(ccc1Cl)[SH-](O)(=O)=O
InChI key: DDVWFZZEYOLGNP-VPMNAVQSSA-L
