(E)-3-(3-bromanyl-4-butoxy-5-methoxy-phenyl)-2-cyano-N-cyclopentyl-prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-4-butoxy-5-methoxy-phenyl)-2-cyano-N-cyclopentyl-prop-2-enamide Openeye Name: (E)-3-(3-bromo-4-butoxy-5-methoxy-phenyl)-2-cyano-N-cyclopentyl-prop-2-enamide CAS Name: (E)-3-(3-bromo-4-butoxy-5-methoxyphenyl)-2-cyano-N-cyclopentyl-2-propenamide IUPAC Name: (E)-3-(3-bromo-4-butoxy-5-methoxyphenyl)-2-cyano-N-cyclopentylprop-2-enamide Traditional Name: (E)-3-(3-bromo-4-butoxy-5-methoxy-phenyl)-2-cyano-N-cyclopentyl-acrylamide Formula: C20H25BrN2O3 MolecularWeight: 421.3281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2CCCC2)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Br)/C=C(\C#N)/C(=O)NC2CCCC2)OC

InChI

InChI=1S/C20H25BrN2O3/c1-3-4-9-26-19-17(21)11-14(12-18(19)25-2)10-15(13-22)20(24)23-16-7-5-6-8-16/h10-12,16H,3-9H2,1-2H3,(H,23,24)/b15-10+