4-[2-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)carbonyl-hydrazinyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)carbonyl-hydrazinyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorobenzoyl)hydrazino]-4-oxo-butanoic acid CAS Name: 4-[2-(1,3-benzodioxol-5-ylmethyl)-2-[(3-chlorophenyl)-oxomethyl]hydrazinyl]-4-oxobutanoic acid IUPAC Name: 4-[2-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorobenzoyl)hydrazinyl]-4-oxobutanoic acid Traditional Name: 4-[N'-(3-chlorobenzoyl)-N'-piperonyl-hydrazino]-4-keto-butyric acid Formula: C19H17ClN2O6 MolecularWeight: 404.80108

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(C(=O)C3=CC(=CC=C3)Cl)NC(=O)CCC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(C(=O)C3=CC(=CC=C3)Cl)NC(=O)CCC(=O)O

InChI

InChI=1S/C19H17ClN2O6/c20-14-3-1-2-13(9-14)19(26)22(21-17(23)6-7-18(24)25)10-12-4-5-15-16(8-12)28-11-27-15/h1-5,8-9H,6-7,10-11H2,(H,21,23)(H,24,25)