3-phenylpropyl 5-[2-(2-nitrophenyl)carbonylhydrazinyl]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[2-(2-nitrophenyl)carbonylhydrazinyl]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[2-(2-nitrobenzoyl)hydrazino]-5-oxo-pentanoate CAS Name: 5-[[(2-nitrophenyl)-oxomethyl]hydrazo]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[2-(2-nitrobenzoyl)hydrazinyl]-5-oxopentanoate Traditional Name: 5-keto-5-[N'-(2-nitrobenzoyl)hydrazino]valeric acid 3-phenylpropyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6/c25-19(22-23-21(27)17-11-4-5-12-18(17)24(28)29)13-6-14-20(26)30-15-7-10-16-8-2-1-3-9-16/h1-5,8-9,11-12H,6-7,10,13-15H2,(H,22,25)(H,23,27)