N-ethyl-4-[4-[(4-methyl-3-nitro-phenyl)carbonylamino]phenyl]piperazine-1-carboxamide

Systemtic Name: N-ethyl-4-[4-[(4-methyl-3-nitro-phenyl)carbonylamino]phenyl]piperazine-1-carboxamide Openeye Name: N-ethyl-4-[4-[(4-methyl-3-nitro-benzoyl)amino]phenyl]piperazine-1-carboxamide CAS Name: N-ethyl-4-[4-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]phenyl]-1-piperazinecarboxamide IUPAC Name: N-ethyl-4-[4-[(4-methyl-3-nitrobenzoyl)amino]phenyl]piperazine-1-carboxamide Traditional Name: N-ethyl-4-[4-[(4-methyl-3-nitro-benzoyl)amino]phenyl]piperazine-1-carboxamide Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O4/c1-3-22-21(28)25-12-10-24(11-13-25)18-8-6-17(7-9-18)23-20(27)16-5-4-15(2)19(14-16)26(29)30/h4-9,14H,3,10-13H2,1-2H3,(H,22,28)(H,23,27)