3-phenylpropyl 4-[2-(4-benzamidophenyl)carbonylhydrazinyl]-4-oxidanylidene-butanoate

Systemtic Name: 3-phenylpropyl 4-[2-(4-benzamidophenyl)carbonylhydrazinyl]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[2-(4-benzamidobenzoyl)hydrazino]-4-oxo-butanoate CAS Name: 4-[[(4-benzamidophenyl)-oxomethyl]hydrazo]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[2-(4-benzamidobenzoyl)hydrazinyl]-4-oxobutanoate Traditional Name: 4-[N'-(4-benzamidobenzoyl)hydrazino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C27H27N3O5 MolecularWeight: 473.52038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCC(=O)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCC(=O)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H27N3O5/c31-24(17-18-25(32)35-19-7-10-20-8-3-1-4-9-20)29-30-27(34)22-13-15-23(16-14-22)28-26(33)21-11-5-2-6-12-21/h1-6,8-9,11-16H,7,10,17-19H2,(H,28,33)(H,29,31)(H,30,34)