5-nitro-N-(3-nitro-4-piperazin-1-yl-phenyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-nitro-N-(3-nitro-4-piperazin-1-yl-phenyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-nitro-N-(3-nitro-4-piperazin-1-yl-phenyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-nitro-N-[3-nitro-4-(1-piperazinyl)phenyl]-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-nitro-N-(3-nitro-4-piperazin-1-ylphenyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-nitro-N-(3-nitro-4-piperazino-phenyl)-2-pyrrolidino-benzamide Formula: C21H24N6O5 MolecularWeight: 440.45246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)N4CCNCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)N4CCNCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N6O5/c28-21(17-14-16(26(29)30)4-6-18(17)24-9-1-2-10-24)23-15-3-5-19(20(13-15)27(31)32)25-11-7-22-8-12-25/h3-6,13-14,22H,1-2,7-12H2,(H,23,28)