3-[[4-(2-dimethylaminoethylcarbamoylamino)-2-oxidanyl-phenyl]sulfonylamino]-4,4-diethoxy-butanoic acid

Systemtic Name: 3-[[4-(2-dimethylaminoethylcarbamoylamino)-2-oxidanyl-phenyl]sulfonylamino]-4,4-diethoxy-butanoic acid Openeye Name: 3-[[4-(2-dimethylaminoethylcarbamoylamino)-2-hydroxy-phenyl]sulfonylamino]-4,4-diethoxy-butanoic acid CAS Name: 3-[[4-[[(2-dimethylaminoethylamino)-oxomethyl]amino]-2-hydroxyphenyl]sulfonylamino]-4,4-diethoxybutanoic acid IUPAC Name: 3-[[4-(2-dimethylaminoethylcarbamoylamino)-2-hydroxyphenyl]sulfonylamino]-4,4-diethoxybutanoic acid Traditional Name: 3-[[4-(2-dimethylaminoethylcarbamoylamino)-2-hydroxy-phenyl]sulfonylamino]-4,4-diethoxy-butyric acid Formula: C19H32N4O8S MolecularWeight: 476.54438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(CC(=O)O)NS(=O)(=O)C1=C(C=C(C=C1)NC(=O)NCCN(C)C)O)OCC

Isomeric SMILES

CCOC(C(CC(=O)O)NS(=O)(=O)C1=C(C=C(C=C1)NC(=O)NCCN(C)C)O)OCC

InChI

InChI=1S/C19H32N4O8S/c1-5-30-18(31-6-2)14(12-17(25)26)22-32(28,29)16-8-7-13(11-15(16)24)21-19(27)20-9-10-23(3)4/h7-8,11,14,18,22,24H,5-6,9-10,12H2,1-4H3,(H,25,26)(H2,20,21,27)