ethyl 4-[3-(methylamino)-4-nitro-phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(methylamino)-4-nitro-phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(methylamino)-4-nitro-phenyl]piperazine-1-carboxylate CAS Name: 4-[3-(methylamino)-4-nitrophenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(methylamino)-4-nitrophenyl]piperazine-1-carboxylate Traditional Name: 4-[3-(methylamino)-4-nitro-phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C14H20N4O4 MolecularWeight: 308.333

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O4/c1-3-22-14(19)17-8-6-16(7-9-17)11-4-5-13(18(20)21)12(10-11)15-2/h4-5,10,15H,3,6-9H2,1-2H3