2-[(2-chlorophenyl)carbonylamino]-3-(3-iodanyl-4-morpholin-4-ylcarbonyloxy-phenyl)propanoic acid

Systemtic Name: 2-[(2-chlorophenyl)carbonylamino]-3-(3-iodanyl-4-morpholin-4-ylcarbonyloxy-phenyl)propanoic acid Openeye Name: 2-[(2-chlorobenzoyl)amino]-3-[3-iodo-4-(morpholine-4-carbonyloxy)phenyl]propanoic acid CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-3-[3-iodo-4-[4-morpholinyl(oxo)methoxy]phenyl]propanoic acid IUPAC Name: 2-[(2-chlorobenzoyl)amino]-3-[3-iodo-4-(morpholine-4-carbonyloxy)phenyl]propanoic acid Traditional Name: 2-[(2-chlorobenzoyl)amino]-3-[3-iodo-4-(morpholine-4-carbonyloxy)phenyl]propionic acid Formula: C21H20ClIN2O6 MolecularWeight: 558.75077

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)OC2=C(C=C(C=C2)CC(C(=O)O)NC(=O)C3=CC=CC=C3Cl)I

Isomeric SMILES

C1COCCN1C(=O)OC2=C(C=C(C=C2)CC(C(=O)O)NC(=O)C3=CC=CC=C3Cl)I

InChI

InChI=1S/C21H20ClIN2O6/c22-15-4-2-1-3-14(15)19(26)24-17(20(27)28)12-13-5-6-18(16(23)11-13)31-21(29)25-7-9-30-10-8-25/h1-6,11,17H,7-10,12H2,(H,24,26)(H,27,28)