[1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 7-chloranyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: [1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 7-chloranyl-1,3-benzodioxole-5-carboxylate Openeye Name: [2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl] 7-chloro-1,3-benzodioxole-5-carboxylate CAS Name: 7-chloro-1,3-benzodioxole-5-carboxylic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 7-chloro-1,3-benzodioxole-5-carboxylate Traditional Name: 7-chloro-piperonylic acid [2-(2-furfurylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H14ClNO6 MolecularWeight: 351.73846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C16H14ClNO6/c1-9(15(19)18-7-11-3-2-4-21-11)24-16(20)10-5-12(17)14-13(6-10)22-8-23-14/h2-6,9H,7-8H2,1H3,(H,18,19)