ethyl 4-[2-(3-methyl-4-nitro-phenoxy)ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(3-methyl-4-nitro-phenoxy)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-methyl-4-nitro-phenoxy)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(3-methyl-4-nitrophenoxy)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-methyl-4-nitrophenoxy)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-methyl-4-nitro-phenoxy)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H21N3O6/c1-3-24-16(21)18-8-6-17(7-9-18)15(20)11-25-13-4-5-14(19(22)23)12(2)10-13/h4-5,10H,3,6-9,11H2,1-2H3