1-(2-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine

Systemtic Name: 1-(2-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Openeye Name: 1-(2-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine CAS Name: 1-(2-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine IUPAC Name: 1-(2-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Traditional Name: 1-(2-chlorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Formula: C19H20ClN3O4 MolecularWeight: 389.8328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=CC=CC=C4Cl

InChI

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