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

Systemtic Name: 3-(3-butoxyphenyl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-(3-butoxyphenyl)prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-(3-butoxyphenyl)-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-(3-butoxyphenyl)prop-2-enenitrile Traditional Name: 2-besyl-3-(3-butoxyphenyl)acrylonitrile Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H19NO3S/c1-2-3-12-23-17-9-7-8-16(13-17)14-19(15-20)24(21,22)18-10-5-4-6-11-18/h4-11,13-14H,2-3,12H2,1H3