1-[2-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[2-(1,3-benzodioxole-5-carbonyl)hydrazino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[2-(1,3-benzodioxole-5-carbonyl)hydrazinyl]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-keto-2-(N'-piperonyloylhydrazino)ethyl]cycloheptanecarboxylic acid Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)NNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)NNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C18H22N2O6/c21-15(10-18(17(23)24)7-3-1-2-4-8-18)19-20-16(22)12-5-6-13-14(9-12)26-11-25-13/h5-6,9H,1-4,7-8,10-11H2,(H,19,21)(H,20,22)(H,23,24)