2-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazole

Systemtic Name: 2-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazole Openeye Name: 2-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazole CAS Name: 2-[[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-1,3-benzoxazole IUPAC Name: 2-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazole Traditional Name: 2-[[4-(2-nitrophenyl)sulfonylpiperazino]methyl]-1,3-benzoxazole Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5S/c23-22(24)15-6-2-4-8-17(15)28(25,26)21-11-9-20(10-12-21)13-18-19-14-5-1-3-7-16(14)27-18/h1-8H,9-13H2