[4-(diphenylmethyl)piperazin-1-yl]-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-1-yl]-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazinyl]-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)methanone Traditional Name: (4-benzhydrylpiperazino)-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)methanone Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4[N+](=O)[O-])OCCO5

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4[N+](=O)[O-])OCCO5

InChI

InChI=1S/C26H25N3O5/c30-26(21-17-23-24(34-16-15-33-23)18-22(21)29(31)32)28-13-11-27(12-14-28)25(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,17-18,25H,11-16H2