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

Systemtic Name: ethyl 4-[3-(cyclopropylamino)-4-nitro-phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(cyclopropylamino)-4-nitro-phenyl]piperazine-1-carboxylate CAS Name: 4-[3-(cyclopropylamino)-4-nitrophenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(cyclopropylamino)-4-nitrophenyl]piperazine-1-carboxylate Traditional Name: 4-[3-(cyclopropylamino)-4-nitro-phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H22N4O4 MolecularWeight: 334.37028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NC3CC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NC3CC3

InChI

InChI=1S/C16H22N4O4/c1-2-24-16(21)19-9-7-18(8-10-19)13-5-6-15(20(22)23)14(11-13)17-12-3-4-12/h5-6,11-12,17H,2-4,7-10H2,1H3