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

Systemtic Name: 1-(3-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Openeye Name: 1-(3-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine CAS Name: 1-(3-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine IUPAC Name: 1-(3-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Traditional Name: 1-(3-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Formula: C19H20ClN3O4 MolecularWeight: 389.8328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H20ClN3O4/c20-16-2-1-3-17(10-16)22-6-4-21(5-7-22)11-14-8-18(23(24)25)9-15-12-26-13-27-19(14)15/h1-3,8-10H,4-7,11-13H2