(4,5-dimethoxy-2-nitro-phenyl)-piperazin-1-yl-methanone

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)-piperazin-1-yl-methanone Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)-piperazin-1-yl-methanone CAS Name: (4,5-dimethoxy-2-nitrophenyl)-(1-piperazinyl)methanone IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)-piperazin-1-ylmethanone Traditional Name: (4,5-dimethoxy-2-nitro-phenyl)-piperazino-methanone Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCNCC2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCNCC2)[N+](=O)[O-])OC

InChI

InChI=1S/C13H17N3O5/c1-20-11-7-9(10(16(18)19)8-12(11)21-2)13(17)15-5-3-14-4-6-15/h7-8,14H,3-6H2,1-2H3