2-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[(7-chloro-1,3-benzodioxole-5-carbonyl)amino]-3-hydroxy-propanoic acid CAS Name: 2-[[(7-chloro-1,3-benzodioxol-5-yl)-oxomethyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[(7-chloro-1,3-benzodioxole-5-carbonyl)amino]-3-hydroxypropanoic acid Traditional Name: 2-[(7-chloropiperonyloyl)amino]-3-hydroxy-propionic acid Formula: C11H10ClNO6 MolecularWeight: 287.6532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10ClNO6/c12-6-1-5(2-8-9(6)19-4-18-8)10(15)13-7(3-14)11(16)17/h1-2,7,14H,3-4H2,(H,13,15)(H,16,17)