N-(2-methyl-5-nitro-phenyl)-2-nitro-5-piperazin-1-yl-benzamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-nitro-5-piperazin-1-yl-benzamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-2-nitro-5-piperazin-1-yl-benzamide CAS Name: N-(2-methyl-5-nitrophenyl)-2-nitro-5-(1-piperazinyl)benzamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-2-nitro-5-piperazin-1-ylbenzamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-2-nitro-5-piperazino-benzamide Formula: C18H19N5O5 MolecularWeight: 385.37396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)N3CCNCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)N3CCNCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O5/c1-12-2-3-14(22(25)26)11-16(12)20-18(24)15-10-13(4-5-17(15)23(27)28)21-8-6-19-7-9-21/h2-5,10-11,19H,6-9H2,1H3,(H,20,24)