[2-[2-(4-chlorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 5-oxidanylidene-5-phenylazanyl-pentanoate

Systemtic Name: [2-[2-(4-chlorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 5-oxidanylidene-5-phenylazanyl-pentanoate Openeye Name: [2-[2-(4-chlorobenzoyl)hydrazino]-2-oxo-ethyl] 5-anilino-5-oxo-pentanoate CAS Name: 5-anilino-5-oxopentanoic acid [2-[[(4-chlorophenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl] 5-anilino-5-oxopentanoate Traditional Name: 5-anilino-5-keto-valeric acid [2-[N'-(4-chlorobenzoyl)hydrazino]-2-keto-ethyl] ester Formula: C20H20ClN3O5 MolecularWeight: 417.8429

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCCC(=O)OCC(=O)NNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCCC(=O)OCC(=O)NNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H20ClN3O5/c21-15-11-9-14(10-12-15)20(28)24-23-18(26)13-29-19(27)8-4-7-17(25)22-16-5-2-1-3-6-16/h1-3,5-6,9-12H,4,7-8,13H2,(H,22,25)(H,23,26)(H,24,28)