N-(1-adamantyl)-4-(4-nitrophenyl)piperazine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-4-(4-nitrophenyl)piperazine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-(4-nitrophenyl)piperazine-1-carboxamide CAS Name: N-(1-adamantyl)-4-(4-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: N-(1-adamantyl)-4-(4-nitrophenyl)piperazine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-(4-nitrophenyl)piperazine-1-carboxamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

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