phenethyl 4-[2-[4-(3-methylbutanoylamino)phenyl]carbonylhydrazinyl]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[2-[4-(3-methylbutanoylamino)phenyl]carbonylhydrazinyl]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-[2-[4-(3-methylbutanoylamino)benzoyl]hydrazino]-4-oxo-butanoate CAS Name: 4-[[[4-[(3-methyl-1-oxobutyl)amino]phenyl]-oxomethyl]hydrazo]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-[2-[4-(3-methylbutanoylamino)benzoyl]hydrazinyl]-4-oxobutanoate Traditional Name: 4-[N'-[4-(isovalerylamino)benzoyl]hydrazino]-4-keto-butyric acid phenethyl ester Formula: C24H29N3O5 MolecularWeight: 439.50416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)CCC(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)CCC(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C24H29N3O5/c1-17(2)16-22(29)25-20-10-8-19(9-11-20)24(31)27-26-21(28)12-13-23(30)32-15-14-18-6-4-3-5-7-18/h3-11,17H,12-16H2,1-2H3,(H,25,29)(H,26,28)(H,27,31)