5280-70-6 (Pigment Yellow 62:1,Pigment Yellow 62:1)

CAS号:
5280-70-6
中文名称:
Pigment Yellow 62:1
英文名称:
Pigment Yellow 62:1
分子式:
C34H30BaN8O14S2
分子量:
976.104200839996

Pigment Yellow 62:1(5280-70-6)名称与标识符

名称

英文别名:
Benzenesulfonic acid, 4-[[1-[[(2-methylphenyl)amino]carbonyl]-2-oxopropyl]azo]-3-nitro-, barium salt (2:1) (9CI);C.I. 13940:1;C.I. Pigment Yellow 62:1;Graphthol Yellow RL-PV;

标识符

InChIKey:
BEHSGLPOGOWHKU-FFRZOONGSA-L
Inchi:
1S/2C17H16N4O7S.Ba/c2*1-10-5-3-4-6-13(10)18-17(23)16(11(2)22)20-19-14-8-7-12(29(26,27)28)9-15(14)21(24)25;/h2*3-9,16H,1-2H3,(H,18,23)(H,26,27,28);/q;;+2/p-2/b2*20-19+;
SMILES:
S(=O)([O-])(C1=CC([N+](=O)[O-])=C(C=C1)/N=N/C(C(C)=O)C(=O)NC1C=CC=CC=1C)=O.S(=O)([O-])(C1=CC([N+](=O)[O-])=C(C=C1)/N=N/C(C(C)=O)C(=O)NC1C=CC=CC=1C)=O.[Ba+2]