(E)-2-[1,1-bis(oxidanylidene)-2-propan-2-yl-3H-1,2-benzothiazol-3-yl]-3-ethoxy-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (E)-2-[1,1-bis(oxidanylidene)-2-propan-2-yl-3H-1,2-benzothiazol-3-yl]-3-ethoxy-3-oxidanyl-prop-2-enenitrile Openeye Name: (E)-3-ethoxy-3-hydroxy-2-(2-isopropyl-1,1-dioxo-3H-1,2-benzothiazol-3-yl)prop-2-enenitrile CAS Name: (E)-2-(1,1-dioxo-2-propan-2-yl-3H-1,2-benzothiazol-3-yl)-3-ethoxy-3-hydroxy-2-propenenitrile IUPAC Name: (E)-2-(1,1-dioxo-2-propan-2-yl-3H-1,2-benzothiazol-3-yl)-3-ethoxy-3-hydroxyprop-2-enenitrile Traditional Name: (E)-3-ethoxy-3-hydroxy-2-(2-isopropyl-1,1-diketo-3H-1,2-benzothiazol-3-yl)acrylonitrile Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C1C2=CC=CC=C2S(=O)(=O)N1C(C)C)O

Isomeric SMILES

CCO/C(=C(/C#N)\C1C2=CC=CC=C2S(=O)(=O)N1C(C)C)/O

InChI

InChI=1S/C15H18N2O4S/c1-4-21-15(18)12(9-16)14-11-7-5-6-8-13(11)22(19,20)17(14)10(2)3/h5-8,10,14,18H,4H2,1-3H3/b15-12-