1-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]isoquinoline-3-carboxylic acid

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]isoquinoline-3-carboxylic acid Openeye Name: 1-(1,1-dioxo-1,4-thiazinan-4-yl)isoquinoline-3-carboxylic acid CAS Name: 1-(1,1-dioxo-1,4-thiazinan-4-yl)-3-isoquinolinecarboxylic acid IUPAC Name: 1-(1,1-dioxo-1,4-thiazinan-4-yl)isoquinoline-3-carboxylic acid Traditional Name: 1-(1,1-diketo-1,4-thiazinan-4-yl)isoquinoline-3-carboxylic acid Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCN1C2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CS(=O)(=O)CCN1C2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C14H14N2O4S/c17-14(18)12-9-10-3-1-2-4-11(10)13(15-12)16-5-7-21(19,20)8-6-16/h1-4,9H,5-8H2,(H,17,18)