4-[bis(2-methoxyethyl)amino]-3-morpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 4-[bis(2-methoxyethyl)amino]-3-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 4-[bis(2-methoxyethyl)amino]-3-morpholinosulfonyl-benzoic acid CAS Name: 4-[bis(2-methoxyethyl)amino]-3-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 4-[bis(2-methoxyethyl)amino]-3-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 4-[bis(2-methoxyethyl)amino]-3-morpholinosulfonyl-benzoic acid Formula: C17H26N2O7S MolecularWeight: 402.46254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCOCC2

Isomeric SMILES

COCCN(CCOC)C1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H26N2O7S/c1-24-9-5-18(6-10-25-2)15-4-3-14(17(20)21)13-16(15)27(22,23)19-7-11-26-12-8-19/h3-4,13H,5-12H2,1-2H3,(H,20,21)