1-[2-[2-[2-(3-bromanylphenoxy)ethanoyl]hydrazinyl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[2-[2-(3-bromanylphenoxy)ethanoyl]hydrazinyl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[2-[2-(3-bromophenoxy)acetyl]hydrazino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[[2-(3-bromophenoxy)-1-oxoethyl]hydrazo]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[2-[2-(3-bromophenoxy)acetyl]hydrazinyl]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-[N'-[2-(3-bromophenoxy)acetyl]hydrazino]-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C18H23BrN2O5 MolecularWeight: 427.28962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)NNC(=O)COC2=CC(=CC=C2)Br)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)NNC(=O)COC2=CC(=CC=C2)Br)C(=O)O

InChI

InChI=1S/C18H23BrN2O5/c19-13-6-5-7-14(10-13)26-12-16(23)21-20-15(22)11-18(17(24)25)8-3-1-2-4-9-18/h5-7,10H,1-4,8-9,11-12H2,(H,20,22)(H,21,23)(H,24,25)