2-[bis[2-(3,4,5-trimethoxyphenyl)carbonyloxyethyl]amino]ethanesulfonic acid

Systemtic Name: 2-[bis[2-(3,4,5-trimethoxyphenyl)carbonyloxyethyl]amino]ethanesulfonic acid Openeye Name: 2-[bis[2-(3,4,5-trimethoxybenzoyl)oxyethyl]amino]ethanesulfonic acid CAS Name: 2-[bis[2-[oxo-(3,4,5-trimethoxyphenyl)methoxy]ethyl]amino]ethanesulfonic acid IUPAC Name: 2-[bis[2-(3,4,5-trimethoxybenzoyl)oxyethyl]amino]ethanesulfonic acid Traditional Name: 2-[bis[2-(3,4,5-trimethoxybenzoyl)oxyethyl]amino]ethanesulfonic acid Formula: C26H35NO13S MolecularWeight: 601.62

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCCN(CCOC(=O)C2=CC(=C(C(=C2)OC)OC)OC)CCS(=O)(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCCN(CCOC(=O)C2=CC(=C(C(=C2)OC)OC)OC)CCS(=O)(=O)O

InChI

InChI=1S/C26H35NO13S/c1-33-19-13-17(14-20(34-2)23(19)37-5)25(28)39-10-7-27(9-12-41(30,31)32)8-11-40-26(29)18-15-21(35-3)24(38-6)22(16-18)36-4/h13-16H,7-12H2,1-6H3,(H,30,31,32)