azane; 5-[1-(3-carboxy-5-chloro-4-hydroxy-phenyl)hentriacont-1-enyl]-3-chloro-2-hydroxy-benzoic acid
Molecular Formula:
C
45
H
71
Cl
2
NO
6
InChI:
InChI=1/C45H68Cl2O6.H3N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-37(35-31-38(44(50)51)42(48)40(46)33-35)36-32-39(45(52)53)43(49)41(47)34-36;/h30-34,48-49H,2-29H2,1H3,(H,50,51)(H,52,53);1H3/f/h50,52H;
InChIKey:
InChIKey=BTRWKFJJDDXLRQ-KNAYWIDJCJ
SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C(C1=CC(=C(C(=C1)Cl)O)C(=O)O)C2=CC(=C(C(=C2)Cl)O)C(=O)O.N
Names:
azane; 5-[1-(3-carboxy-5-chloro-4-hydroxy-phenyl)hentriacont-1-enyl]-3-chloro-2-hydroxy-benzoic acid
Registries:
PubChem CID 370481
PubChem ID 10267124
