phenethyl 4-[2-[4-[(2-methylphenyl)carbonylamino]phenyl]carbonylhydrazinyl]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[2-[4-[(2-methylphenyl)carbonylamino]phenyl]carbonylhydrazinyl]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-[2-[4-[(2-methylbenzoyl)amino]benzoyl]hydrazino]-4-oxo-butanoate CAS Name: 4-[[[4-[[(2-methylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]hydrazo]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-[2-[4-[(2-methylbenzoyl)amino]benzoyl]hydrazinyl]-4-oxobutanoate Traditional Name: 4-keto-4-[N'-[4-(o-toluoylamino)benzoyl]hydrazino]butyric acid phenethyl ester Formula: C27H27N3O5 MolecularWeight: 473.52038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)CCC(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)CCC(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C27H27N3O5/c1-19-7-5-6-10-23(19)27(34)28-22-13-11-21(12-14-22)26(33)30-29-24(31)15-16-25(32)35-18-17-20-8-3-2-4-9-20/h2-14H,15-18H2,1H3,(H,28,34)(H,29,31)(H,30,33)