4-cyclohexyl-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-cyclohexyl-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-cyclohexyl-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-cyclohexyl-N-(4-nitrophenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-cyclohexyl-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-cyclohexyl-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide Formula: C17H25N4O3+ MolecularWeight: 333.4054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H24N4O3/c22-17(18-14-6-8-16(9-7-14)21(23)24)20-12-10-19(11-13-20)15-4-2-1-3-5-15/h6-9,15H,1-5,10-13H2,(H,18,22)/p+1