9-oxidanylidenenonyl 2-(1,3-benzothiazol-2-ylsulfonyl)ethanoate

Systemtic Name: 9-oxidanylidenenonyl 2-(1,3-benzothiazol-2-ylsulfonyl)ethanoate Openeye Name: 9-oxononyl 2-(1,3-benzothiazol-2-ylsulfonyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylsulfonyl)acetic acid 9-oxononyl ester IUPAC Name: 9-oxononyl 2-(1,3-benzothiazol-2-ylsulfonyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylsulfonyl)acetic acid 9-ketononyl ester Formula: C18H23NO5S2 MolecularWeight: 397.50892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CC(=O)OCCCCCCCCC=O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CC(=O)OCCCCCCCCC=O

InChI

InChI=1S/C18H23NO5S2/c20-12-8-4-2-1-3-5-9-13-24-17(21)14-26(22,23)18-19-15-10-6-7-11-16(15)25-18/h6-7,10-12H,1-5,8-9,13-14H2