[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 7-chloranyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 7-chloranyl-1,3-benzodioxole-5-carboxylate Openeye Name: [2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl] 7-chloro-1,3-benzodioxole-5-carboxylate CAS Name: 7-chloro-1,3-benzodioxole-5-carboxylic acid [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] 7-chloro-1,3-benzodioxole-5-carboxylate Traditional Name: 7-chloro-piperonylic acid [2-[(4-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C17H13Cl2NO5 MolecularWeight: 382.19482

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C(=O)OCC(=O)NCC3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)C(=O)OCC(=O)NCC3=CC=C(C=C3)Cl)Cl

InChI

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