2-azanyl-5-(4-azanyl-3-sulfonato-phenyl)sulfonyl-benzenesulfonate; triethylazanium

Systemtic Name: 2-azanyl-5-(4-azanyl-3-sulfonato-phenyl)sulfonyl-benzenesulfonate; triethylazanium Openeye Name: 2-amino-5-(4-amino-3-sulfonato-phenyl)sulfonyl-benzenesulfonate; triethylammonium CAS Name: 2-amino-5-(4-amino-3-sulfonatophenyl)sulfonylbenzenesulfonate; triethylammonium IUPAC Name: 2-amino-5-(4-amino-3-sulfonatophenyl)sulfonylbenzenesulfonate; triethylazanium Traditional Name: 2-amino-5-(4-amino-3-sulfonato-phenyl)sulfonyl-besylate; triethylammonium Formula: C24H42N4O8S3 MolecularWeight: 610.80728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC.CC[NH+](CC)CC.C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N

Isomeric SMILES

CC[NH+](CC)CC.CC[NH+](CC)CC.C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N

InChI

InChI=1S/C12H12N2O8S3.2C6H15N/c13-9-3-1-7(5-11(9)24(17,18)19)23(15,16)8-2-4-10(14)12(6-8)25(20,21)22;2*1-4-7(5-2)6-3/h1-6H,13-14H2,(H,17,18,19)(H,20,21,22);2*4-6H2,1-3H3