4-(4-nitrophenyl)-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide

Systemtic Name: 4-(4-nitrophenyl)-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide Openeye Name: 4-(4-nitrophenyl)-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide CAS Name: 4-(4-nitrophenyl)-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide IUPAC Name: 4-(4-nitrophenyl)-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide Traditional Name: 4-(4-nitrophenyl)-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide Formula: C14H12N2O5S MolecularWeight: 320.32048

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=CC=CC=C2OS1(=O)=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(NC2=CC=CC=C2OS1(=O)=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O5S/c17-16(18)11-7-5-10(6-8-11)13-9-22(19,20)21-14-4-2-1-3-12(14)15-13/h1-8,13,15H,9H2