3-(1,3-benzodioxol-5-yl)-3-[(2,4-dichlorophenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-3-[(2,4-dichlorophenyl)carbonylamino]propanoic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-3-[(2,4-dichlorobenzoyl)amino]propanoic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-3-[[(2,4-dichlorophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-[(2,4-dichlorobenzoyl)amino]propanoic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-[(2,4-dichlorobenzoyl)amino]propionic acid Formula: C17H13Cl2NO5 MolecularWeight: 382.19482

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC(=O)O)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CC(=O)O)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2NO5/c18-10-2-3-11(12(19)6-10)17(23)20-13(7-16(21)22)9-1-4-14-15(5-9)25-8-24-14/h1-6,13H,7-8H2,(H,20,23)(H,21,22)