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

Systemtic Name: 1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-[(4-propan-2-ylphenyl)methyl]piperazine Openeye Name: 1-[(4-isopropylphenyl)methyl]-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine CAS Name: 1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-[(4-propan-2-ylphenyl)methyl]piperazine IUPAC Name: 1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-[(4-propan-2-ylphenyl)methyl]piperazine Traditional Name: 1-(4-isopropylbenzyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C23H29N3O4/c1-17(2)19-5-3-18(4-6-19)13-24-7-9-25(10-8-24)14-20-11-22(26(27)28)12-21-15-29-16-30-23(20)21/h3-6,11-12,17H,7-10,13-16H2,1-2H3