3-(2-pentoxyphenyl)-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-(2-pentoxyphenyl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-(2-pentoxyphenyl)prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-(2-pentoxyphenyl)-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-(2-pentoxyphenyl)prop-2-enenitrile Traditional Name: 3-(2-amoxyphenyl)-2-besyl-acrylonitrile Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C=C(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCOC1=CC=CC=C1C=C(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H21NO3S/c1-2-3-9-14-24-20-13-8-7-10-17(20)15-19(16-21)25(22,23)18-11-5-4-6-12-18/h4-8,10-13,15H,2-3,9,14H2,1H3