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benzo[f][1]benzothiol-4-yl 4-nitrobenzenesulfonate

benzo[f][1]benzothiol-4-yl 4-nitrobenzenesulfonate

Systemtic Name:benzo[f][1]benzothiol-4-yl 4-nitrobenzenesulfonate
Openeye Name:benzo[f]benzothiophen-4-yl 4-nitrobenzenesulfonate
CAS Name:4-nitrobenzenesulfonic acid 4-benzo[f][1]benzothiolyl ester
IUPAC Name:benzo[f][1]benzothiol-4-yl 4-nitrobenzenesulfonate
Traditional Name:4-nitrobenzenesulfonic acid benzo[f]benzothiophen-4-yl ester
Formula: C18H11NO5S2
MolecularWeight: 385.41364
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C(=C2OS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C=CS3


Isomeric SMILES

C1=CC=C2C(=C1)C=C3C(=C2OS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C=CS3


InChI

InChI=1S/C18H11NO5S2/c20-19(21)13-5-7-14(8-6-13)26(22,23)24-18-15-4-2-1-3-12(15)11-17-16(18)9-10-25-17/h1-11H


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