4-[4-(4-nitrophenyl)piperazin-1-yl]butanoate

Systemtic Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]butanoate Openeye Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]butanoate CAS Name: 4-[4-(4-nitrophenyl)-1-piperazinyl]butanoate IUPAC Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]butanoate Traditional Name: 4-[4-(4-nitrophenyl)piperazino]butyrate Formula: C14H18N3O4- MolecularWeight: 292.31042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCCC(=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O4/c18-14(19)2-1-7-15-8-10-16(11-9-15)12-3-5-13(6-4-12)17(20)21/h3-6H,1-2,7-11H2,(H,18,19)/p-1