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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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