(E)-3-(azepan-1-yl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(azepan-1-yl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(azepan-1-yl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(1-azepanyl)-2-(4-chlorophenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(azepan-1-yl)-2-(4-chlorophenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(azepan-1-yl)-2-(4-chlorophenyl)sulfonyl-acrylonitrile Formula: C15H17ClN2O2S MolecularWeight: 324.82568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCCN(CC1)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H17ClN2O2S/c16-13-5-7-14(8-6-13)21(19,20)15(11-17)12-18-9-3-1-2-4-10-18/h5-8,12H,1-4,9-10H2/b15-12+