HIT ID: HIT214319163
Cas No: 3564-15-6
分子式: C22H17N7NaO6S
分子量: 530.47
常用名: C.I. Mordant Brown 1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-(2-{2,4-diamino-5-[2-(2-hydroxy-5-nitrophenyl)diazen-1-yl]phenyl}diazen-1-yl)naphthalene-1-sulfonic acid sodium
IUPAC: 5-(2-{2,4-diamino-5-[2-(2-hydroxy-5-nitrophenyl)diazen-1-yl]phenyl}diazen-1-yl)naphthalene-1-sulfonic acid sodium
SMILES: [Na].Nc1cc(N)c(cc1N=Nc1cc(ccc1O)N(=O)=O)N=Nc1cccc2c(cccc12)S(O)(=O)=O |w:10.10,21.21|jcExt:v:0:0
SMILES: [Na].Nc1cc(N)c(cc1N=Nc1cc(ccc1O)N(=O)=O)N=Nc1cccc2c(cccc12)S(O)(=O)=O |w:10.10,21.21|jcExt:v:0:0
InChI key: FYPOANGYTWRVNP-UHFFFAOYSA-N
