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

Systemtic Name: 1-[(3-chlorophenyl)methyl]-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Openeye Name: 1-[(3-chlorophenyl)methyl]-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine CAS Name: 1-[(3-chlorophenyl)methyl]-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine IUPAC Name: 1-[(3-chlorophenyl)methyl]-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Traditional Name: 1-(3-chlorobenzyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Cl)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Cl)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C20H22ClN3O4/c21-18-3-1-2-15(8-18)11-22-4-6-23(7-5-22)12-16-9-19(24(25)26)10-17-13-27-14-28-20(16)17/h1-3,8-10H,4-7,11-14H2