1-[2-[2-[4-(2-methylpropoxy)phenyl]carbonylhydrazinyl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[2-[4-(2-methylpropoxy)phenyl]carbonylhydrazinyl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[2-(4-isobutoxybenzoyl)hydrazino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[[[4-(2-methylpropoxy)phenyl]-oxomethyl]hydrazo]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[2-[4-(2-methylpropoxy)benzoyl]hydrazinyl]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-[N'-(4-isobutoxybenzoyl)hydrazino]-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NNC(=O)CC2(CCCCCC2)C(=O)O

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)NNC(=O)CC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C21H30N2O5/c1-15(2)14-28-17-9-7-16(8-10-17)19(25)23-22-18(24)13-21(20(26)27)11-5-3-4-6-12-21/h7-10,15H,3-6,11-14H2,1-2H3,(H,22,24)(H,23,25)(H,26,27)