3-nitro-N-(3-nitro-4-piperazin-1-yl-phenyl)-4-piperidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-(3-nitro-4-piperazin-1-yl-phenyl)-4-piperidin-1-yl-benzamide Openeye Name: 3-nitro-N-(3-nitro-4-piperazin-1-yl-phenyl)-4-(1-piperidyl)benzamide CAS Name: 3-nitro-N-[3-nitro-4-(1-piperazinyl)phenyl]-4-(1-piperidinyl)benzamide IUPAC Name: 3-nitro-N-(3-nitro-4-piperazin-1-ylphenyl)-4-piperidin-1-ylbenzamide Traditional Name: 3-nitro-N-(3-nitro-4-piperazino-phenyl)-4-piperidino-benzamide Formula: C22H26N6O5 MolecularWeight: 454.47904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCNCC4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCNCC4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H26N6O5/c29-22(16-4-6-18(20(14-16)27(30)31)25-10-2-1-3-11-25)24-17-5-7-19(21(15-17)28(32)33)26-12-8-23-9-13-26/h4-7,14-15,23H,1-3,8-13H2,(H,24,29)