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

Systemtic Name: 3-phenylpropyl 4-[2-[2-(4-bromanylphenoxy)ethanoyl]hydrazinyl]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[2-[2-(4-bromophenoxy)acetyl]hydrazino]-4-oxo-butanoate CAS Name: 4-[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[2-[2-(4-bromophenoxy)acetyl]hydrazinyl]-4-oxobutanoate Traditional Name: 4-[N'-[2-(4-bromophenoxy)acetyl]hydrazino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C21H23BrN2O5 MolecularWeight: 463.32172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrN2O5/c22-17-8-10-18(11-9-17)29-15-20(26)24-23-19(25)12-13-21(27)28-14-4-7-16-5-2-1-3-6-16/h1-3,5-6,8-11H,4,7,12-15H2,(H,23,25)(H,24,26)