[(E)-4-phenylmethoxybut-2-enyl] 4-(4-nitrophenyl)piperazine-1-carboxylate

Systemtic Name: [(E)-4-phenylmethoxybut-2-enyl] 4-(4-nitrophenyl)piperazine-1-carboxylate Openeye Name: [(E)-4-benzyloxybut-2-enyl] 4-(4-nitrophenyl)piperazine-1-carboxylate CAS Name: 4-(4-nitrophenyl)-1-piperazinecarboxylic acid [(E)-4-phenylmethoxybut-2-enyl] ester IUPAC Name: [(E)-4-phenylmethoxybut-2-enyl] 4-(4-nitrophenyl)piperazine-1-carboxylate Traditional Name: 4-(4-nitrophenyl)piperazine-1-carboxylic acid [(E)-4-benzoxybut-2-enyl] ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC=CCOCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC/C=C/COCC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O5/c26-22(30-17-5-4-16-29-18-19-6-2-1-3-7-19)24-14-12-23(13-15-24)20-8-10-21(11-9-20)25(27)28/h1-11H,12-18H2/b5-4+