3-[4-[[2,6-bis(chloranyl)phenyl]methoxy]phenyl]-2-[(5-morpholin-4-ylcarbonyl-1,3-dioxolan-4-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[4-[[2,6-bis(chloranyl)phenyl]methoxy]phenyl]-2-[(5-morpholin-4-ylcarbonyl-1,3-dioxolan-4-yl)carbonylamino]propanoic acid Openeye Name: 3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-2-[[5-(morpholine-4-carbonyl)-1,3-dioxolane-4-carbonyl]amino]propanoic acid CAS Name: 3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-2-[[[5-[4-morpholinyl(oxo)methyl]-1,3-dioxolan-4-yl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-2-[[5-(morpholine-4-carbonyl)-1,3-dioxolane-4-carbonyl]amino]propanoic acid Traditional Name: 3-[4-(2,6-dichlorobenzyl)oxyphenyl]-2-[[5-(morpholine-4-carbonyl)-1,3-dioxolane-4-carbonyl]amino]propionic acid Formula: C25H26Cl2N2O8 MolecularWeight: 553.38854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2C(OCO2)C(=O)NC(CC3=CC=C(C=C3)OCC4=C(C=CC=C4Cl)Cl)C(=O)O

Isomeric SMILES

C1COCCN1C(=O)C2C(OCO2)C(=O)NC(CC3=CC=C(C=C3)OCC4=C(C=CC=C4Cl)Cl)C(=O)O

InChI

InChI=1S/C25H26Cl2N2O8/c26-18-2-1-3-19(27)17(18)13-35-16-6-4-15(5-7-16)12-20(25(32)33)28-23(30)21-22(37-14-36-21)24(31)29-8-10-34-11-9-29/h1-7,20-22H,8-14H2,(H,28,30)(H,32,33)