1,4-bis[(4-nitrophenyl)methylsulfonyl]-1,4-diazepane

Systemtic Name: 1,4-bis[(4-nitrophenyl)methylsulfonyl]-1,4-diazepane Openeye Name: 1,4-bis[(4-nitrophenyl)methylsulfonyl]-1,4-diazepane CAS Name: 1,4-bis[(4-nitrophenyl)methylsulfonyl]-1,4-diazepane IUPAC Name: 1,4-bis[(4-nitrophenyl)methylsulfonyl]-1,4-diazepane Traditional Name: 1,4-bis[(4-nitrobenzyl)sulfonyl]-1,4-diazepane Formula: C19H22N4O8S2 MolecularWeight: 498.52998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)CC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)CC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O8S2/c24-22(25)18-6-2-16(3-7-18)14-32(28,29)20-10-1-11-21(13-12-20)33(30,31)15-17-4-8-19(9-5-17)23(26)27/h2-9H,1,10-15H2