3-phenylpropyl 5-[2-[2-(4-bromanylphenoxy)ethanoyl]hydrazinyl]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[2-[2-(4-bromanylphenoxy)ethanoyl]hydrazinyl]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[2-[2-(4-bromophenoxy)acetyl]hydrazino]-5-oxo-pentanoate CAS Name: 5-[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[2-[2-(4-bromophenoxy)acetyl]hydrazinyl]-5-oxopentanoate Traditional Name: 5-[N'-[2-(4-bromophenoxy)acetyl]hydrazino]-5-keto-valeric acid 3-phenylpropyl ester Formula: C22H25BrN2O5 MolecularWeight: 477.3483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NNC(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NNC(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C22H25BrN2O5/c23-18-11-13-19(14-12-18)30-16-21(27)25-24-20(26)9-4-10-22(28)29-15-5-8-17-6-2-1-3-7-17/h1-3,6-7,11-14H,4-5,8-10,15-16H2,(H,24,26)(H,25,27)