5-[4-[2-(4-nitrophenoxy)ethanoyl]piperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-[2-(4-nitrophenoxy)ethanoyl]piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-[2-(4-nitrophenoxy)acetyl]piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[4-[2-(4-nitrophenoxy)-1-oxoethyl]-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: 5-[4-[2-(4-nitrophenoxy)acetyl]piperazin-1-yl]-5-oxopentanoic acid Traditional Name: 5-keto-5-[4-[2-(4-nitrophenoxy)acetyl]piperazino]valeric acid Formula: C17H21N3O7 MolecularWeight: 379.36454

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCC(=O)O)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CCCC(=O)O)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O7/c21-15(2-1-3-17(23)24)18-8-10-19(11-9-18)16(22)12-27-14-6-4-13(5-7-14)20(25)26/h4-7H,1-3,8-12H2,(H,23,24)