(E)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-hexyl-prop-2-enamide

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-hexyl-prop-2-enamide Openeye Name: (E)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-hexyl-prop-2-enamide CAS Name: (E)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-hexyl-2-propenamide IUPAC Name: (E)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-hexylprop-2-enamide Traditional Name: (E)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-hexyl-acrylamide Formula: C17H21ClN2O3 MolecularWeight: 336.81324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C(=CC1=CC(=C(C(=C1)Cl)O)OC)C#N

Isomeric SMILES

CCCCCCNC(=O)/C(=C/C1=CC(=C(C(=C1)Cl)O)OC)/C#N

InChI

InChI=1S/C17H21ClN2O3/c1-3-4-5-6-7-20-17(22)13(11-19)8-12-9-14(18)16(21)15(10-12)23-2/h8-10,21H,3-7H2,1-2H3,(H,20,22)/b13-8+