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

Systemtic Name: phenethyl 4-[2-[4-[(3-methylphenyl)carbonylamino]phenyl]carbonylhydrazinyl]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-[2-[4-[(3-methylbenzoyl)amino]benzoyl]hydrazino]-4-oxo-butanoate CAS Name: 4-[[[4-[[(3-methylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]hydrazo]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-[2-[4-[(3-methylbenzoyl)amino]benzoyl]hydrazinyl]-4-oxobutanoate Traditional Name: 4-keto-4-[N'-[4-(m-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(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)CCC(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)CCC(=O)OCCC3=CC=CC=C3

InChI

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