(4-nitrophenyl)methyl 2-piperazin-1-ylethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-piperazin-1-ylethanoate Openeye Name: (4-nitrophenyl)methyl 2-piperazin-1-ylacetate CAS Name: 2-(1-piperazinyl)acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-piperazin-1-ylacetate Traditional Name: 2-piperazinoacetic acid (4-nitrobenzyl) ester Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O4/c17-13(9-15-7-5-14-6-8-15)20-10-11-1-3-12(4-2-11)16(18)19/h1-4,14H,5-10H2