(Z)-3-(1,3-benzodioxol-5-yl)-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: (Z)-2-(benzenesulfonyl)-3-(1,3-benzodioxol-5-yl)prop-2-enenitrile CAS Name: (Z)-2-(benzenesulfonyl)-3-(1,3-benzodioxol-5-yl)-2-propenenitrile IUPAC Name: (Z)-2-(benzenesulfonyl)-3-(1,3-benzodioxol-5-yl)prop-2-enenitrile Traditional Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-besyl-acrylonitrile Formula: C16H11NO4S MolecularWeight: 313.32784

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(/C#N)\S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H11NO4S/c17-10-14(22(18,19)13-4-2-1-3-5-13)8-12-6-7-15-16(9-12)21-11-20-15/h1-9H,11H2/b14-8-