3-phenylpropyl 4-[2-(2-iodanylphenyl)carbonylhydrazinyl]-4-oxidanylidene-butanoate

Systemtic Name: 3-phenylpropyl 4-[2-(2-iodanylphenyl)carbonylhydrazinyl]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[2-(2-iodobenzoyl)hydrazino]-4-oxo-butanoate CAS Name: 4-[[(2-iodophenyl)-oxomethyl]hydrazo]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[2-(2-iodobenzoyl)hydrazinyl]-4-oxobutanoate Traditional Name: 4-[N'-(2-iodobenzoyl)hydrazino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C20H21IN2O4 MolecularWeight: 480.29621

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCC(=O)NNC(=O)C2=CC=CC=C2I

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCC(=O)NNC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C20H21IN2O4/c21-17-11-5-4-10-16(17)20(26)23-22-18(24)12-13-19(25)27-14-6-9-15-7-2-1-3-8-15/h1-5,7-8,10-11H,6,9,12-14H2,(H,22,24)(H,23,26)