4-[(4-nitrophenyl)methyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[(4-nitrophenyl)methyl]piperazine-1-carbaldehyde Openeye Name: 4-[(4-nitrophenyl)methyl]piperazine-1-carbaldehyde CAS Name: 4-[(4-nitrophenyl)methyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[(4-nitrophenyl)methyl]piperazine-1-carbaldehyde Traditional Name: 4-(4-nitrobenzyl)piperazine-1-carbaldehyde Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])C=O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])C=O

InChI

InChI=1S/C12H15N3O3/c16-10-14-7-5-13(6-8-14)9-11-1-3-12(4-2-11)15(17)18/h1-4,10H,5-9H2