[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 7-chloranyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 7-chloranyl-1,3-benzodioxole-5-carboxylate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 7-chloro-1,3-benzodioxole-5-carboxylate CAS Name: 7-chloro-1,3-benzodioxole-5-carboxylic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 7-chloro-1,3-benzodioxole-5-carboxylate Traditional Name: 7-chloro-piperonylic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C16H11ClINO5 MolecularWeight: 459.61971

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)I)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)I)Cl

InChI

InChI=1S/C16H11ClINO5/c17-12-4-9(5-13-15(12)24-8-23-13)16(21)22-7-14(20)19-11-3-1-2-10(18)6-11/h1-6H,7-8H2,(H,19,20)