ethyl 4-(2-chloranyl-4-nitro-phenyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(2-chloranyl-4-nitro-phenyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(2-chloro-4-nitro-phenyl)piperazine-1-carboxylate CAS Name: 4-(2-chloro-4-nitrophenyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-4-nitrophenyl)piperazine-1-carboxylate Traditional Name: 4-(2-chloro-4-nitro-phenyl)piperazine-1-carboxylic acid ethyl ester Formula: C13H16ClN3O4 MolecularWeight: 313.73684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H16ClN3O4/c1-2-21-13(18)16-7-5-15(6-8-16)12-4-3-10(17(19)20)9-11(12)14/h3-4,9H,2,5-8H2,1H3