3-(morpholin-4-ium-4-ylmethyl)-1,3-benzothiazol-2-one

Systemtic Name: 3-(morpholin-4-ium-4-ylmethyl)-1,3-benzothiazol-2-one Openeye Name: 3-(morpholin-4-ium-4-ylmethyl)-1,3-benzothiazol-2-one CAS Name: 3-(4-morpholin-4-iumylmethyl)-1,3-benzothiazol-2-one IUPAC Name: 3-(morpholin-4-ium-4-ylmethyl)-1,3-benzothiazol-2-one Traditional Name: 3-(morpholin-4-ium-4-ylmethyl)-1,3-benzothiazol-2-one Formula: C12H15N2O2S+ MolecularWeight: 251.3247

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C3=CC=CC=C3SC2=O

Isomeric SMILES

C1COCC[NH+]1CN2C3=CC=CC=C3SC2=O

InChI

InChI=1S/C12H14N2O2S/c15-12-14(9-13-5-7-16-8-6-13)10-3-1-2-4-11(10)17-12/h1-4H,5-9H2/p+1