2-[(4-oxidanylpyrrolidin-2-yl)carbonylamino]-3-(4-thiomorpholin-4-ylcarbonyloxyphenyl)propanoic acid

Systemtic Name: 2-[(4-oxidanylpyrrolidin-2-yl)carbonylamino]-3-(4-thiomorpholin-4-ylcarbonyloxyphenyl)propanoic acid Openeye Name: 2-[(4-hydroxypyrrolidine-2-carbonyl)amino]-3-[4-(thiomorpholine-4-carbonyloxy)phenyl]propanoic acid CAS Name: 2-[[(4-hydroxy-2-pyrrolidinyl)-oxomethyl]amino]-3-[4-[oxo(thiomorpholin-4-yl)methoxy]phenyl]propanoic acid IUPAC Name: 2-[(4-hydroxypyrrolidine-2-carbonyl)amino]-3-[4-(thiomorpholine-4-carbonyloxy)phenyl]propanoic acid Traditional Name: 2-[(4-hydroxyprolyl)amino]-3-[4-(thiomorpholine-4-carbonyloxy)phenyl]propionic acid Formula: C19H25N3O6S MolecularWeight: 423.4833

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)OC2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3CC(CN3)O

Isomeric SMILES

C1CSCCN1C(=O)OC2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3CC(CN3)O

InChI

InChI=1S/C19H25N3O6S/c23-13-10-15(20-11-13)17(24)21-16(18(25)26)9-12-1-3-14(4-2-12)28-19(27)22-5-7-29-8-6-22/h1-4,13,15-16,20,23H,5-11H2,(H,21,24)(H,25,26)