1-[2-[2-(4-ethoxy-3-methoxy-phenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[2-(4-ethoxy-3-methoxy-phenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[2-(4-ethoxy-3-methoxy-benzoyl)hydrazino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[[(4-ethoxy-3-methoxyphenyl)-oxomethyl]hydrazo]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[2-(4-ethoxy-3-methoxybenzoyl)hydrazinyl]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-[N'-(4-ethoxy-3-methoxy-benzoyl)hydrazino]-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NNC(=O)CC2(CCCCCC2)C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NNC(=O)CC2(CCCCCC2)C(=O)O)OC

InChI

InChI=1S/C20H28N2O6/c1-3-28-15-9-8-14(12-16(15)27-2)18(24)22-21-17(23)13-20(19(25)26)10-6-4-5-7-11-20/h8-9,12H,3-7,10-11,13H2,1-2H3,(H,21,23)(H,22,24)(H,25,26)