[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 5-[[4-(4-methylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 5-[[4-(4-methylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] 5-[4-(4-methylphenoxy)anilino]-5-oxo-pentanoate CAS Name: 5-[4-(4-methylphenoxy)anilino]-5-oxopentanoic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] 5-[4-(4-methylphenoxy)anilino]-5-oxopentanoate Traditional Name: 5-keto-5-[4-(4-methylphenoxy)anilino]valeric acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C27H27N3O6 MolecularWeight: 489.51978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)NNC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)NNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H27N3O6/c1-19-10-14-22(15-11-19)36-23-16-12-21(13-17-23)28-24(31)8-5-9-26(33)35-18-25(32)29-30-27(34)20-6-3-2-4-7-20/h2-4,6-7,10-17H,5,8-9,18H2,1H3,(H,28,31)(H,29,32)(H,30,34)