N-cyclohexyl-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine-1-carboxamide

Systemtic Name: N-cyclohexyl-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine-1-carboxamide Openeye Name: N-cyclohexyl-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine-1-carboxamide CAS Name: N-cyclohexyl-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-piperazinecarboxamide IUPAC Name: N-cyclohexyl-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine-1-carboxamide Traditional Name: N-cyclohexyl-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine-1-carboxamide Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCN(CC2)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCN(CC2)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C20H28N4O5/c25-20(21-17-4-2-1-3-5-17)23-8-6-22(7-9-23)12-15-10-18(24(26)27)11-16-13-28-14-29-19(15)16/h10-11,17H,1-9,12-14H2,(H,21,25)