N-(1-adamantyl)-3-nitro-4-piperazin-1-yl-benzamide

Systemtic Name: N-(1-adamantyl)-3-nitro-4-piperazin-1-yl-benzamide Openeye Name: N-(1-adamantyl)-3-nitro-4-piperazin-1-yl-benzamide CAS Name: N-(1-adamantyl)-3-nitro-4-(1-piperazinyl)benzamide IUPAC Name: N-(1-adamantyl)-3-nitro-4-piperazin-1-ylbenzamide Traditional Name: N-(1-adamantyl)-3-nitro-4-piperazino-benzamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O3/c26-20(23-21-11-14-7-15(12-21)9-16(8-14)13-21)17-1-2-18(19(10-17)25(27)28)24-5-3-22-4-6-24/h1-2,10,14-16,22H,3-9,11-13H2,(H,23,26)