4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]-N,N-dimethyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]-N,N-dimethyl-piperazine-1-carboxamide Openeye Name: 4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]-N,N-dimethyl-piperazine-1-carboxamide CAS Name: 4-[2-(2,5-dimethyl-1-pyrrolyl)-4-nitrophenyl]-N,N-dimethyl-1-piperazinecarboxamide IUPAC Name: 4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitrophenyl]-N,N-dimethylpiperazine-1-carboxamide Traditional Name: 4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]-N,N-dimethyl-piperazine-1-carboxamide Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)C(=O)N(C)C)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)C(=O)N(C)C)C

InChI

InChI=1S/C19H25N5O3/c1-14-5-6-15(2)23(14)18-13-16(24(26)27)7-8-17(18)21-9-11-22(12-10-21)19(25)20(3)4/h5-8,13H,9-12H2,1-4H3