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

Systemtic Name: methyl 2-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[(7-chloro-1,3-benzodioxole-5-carbonyl)amino]-3-hydroxy-propanoate CAS Name: 2-[[(7-chloro-1,3-benzodioxol-5-yl)-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[(7-chloro-1,3-benzodioxole-5-carbonyl)amino]-3-hydroxypropanoate Traditional Name: 2-[(7-chloropiperonyloyl)amino]-3-hydroxy-propionic acid methyl ester Formula: C12H12ClNO6 MolecularWeight: 301.67978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC2=C(C(=C1)Cl)OCO2

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC2=C(C(=C1)Cl)OCO2

InChI

InChI=1S/C12H12ClNO6/c1-18-12(17)8(4-15)14-11(16)6-2-7(13)10-9(3-6)19-5-20-10/h2-3,8,15H,4-5H2,1H3,(H,14,16)