5-[4-(4-nitrophenyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-(4-nitrophenyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(4-nitrophenyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[4-(4-nitrophenyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: 5-[4-(4-nitrophenyl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: 5-keto-5-[4-(4-nitrophenyl)piperazino]valeric acid Formula: C15H19N3O5 MolecularWeight: 321.32846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCCC(=O)O

InChI

InChI=1S/C15H19N3O5/c19-14(2-1-3-15(20)21)17-10-8-16(9-11-17)12-4-6-13(7-5-12)18(22)23/h4-7H,1-3,8-11H2,(H,20,21)