3-[(3-nitrophenyl)methoxy]-1,2-benzothiazole 1,1-dioxide

Systemtic Name: 3-[(3-nitrophenyl)methoxy]-1,2-benzothiazole 1,1-dioxide Openeye Name: 3-[(3-nitrophenyl)methoxy]-1,2-benzothiazole 1,1-dioxide CAS Name: 3-[(3-nitrophenyl)methoxy]-1,2-benzothiazole 1,1-dioxide IUPAC Name: 3-[(3-nitrophenyl)methoxy]-1,2-benzothiazole 1,1-dioxide Traditional Name: 3-(3-nitrobenzyl)oxy-1,2-benzothiazole 1,1-dioxide Formula: C14H10N2O5S MolecularWeight: 318.3046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O5S/c17-16(18)11-5-3-4-10(8-11)9-21-14-12-6-1-2-7-13(12)22(19,20)15-14/h1-8H,9H2