N,N-diethyl-4-[2-[(3-nitrophenyl)carbonylamino]ethanoyl]piperazine-1-carboxamide

Systemtic Name: N,N-diethyl-4-[2-[(3-nitrophenyl)carbonylamino]ethanoyl]piperazine-1-carboxamide Openeye Name: N,N-diethyl-4-[2-[(3-nitrobenzoyl)amino]acetyl]piperazine-1-carboxamide CAS Name: N,N-diethyl-4-[2-[[(3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]-1-piperazinecarboxamide IUPAC Name: N,N-diethyl-4-[2-[(3-nitrobenzoyl)amino]acetyl]piperazine-1-carboxamide Traditional Name: N,N-diethyl-4-[2-[(3-nitrobenzoyl)amino]acetyl]piperazine-1-carboxamide Formula: C18H25N5O5 MolecularWeight: 391.4216

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O5/c1-3-20(4-2)18(26)22-10-8-21(9-11-22)16(24)13-19-17(25)14-6-5-7-15(12-14)23(27)28/h5-7,12H,3-4,8-11,13H2,1-2H3,(H,19,25)