(E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Openeye Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide CAS Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Traditional Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]acrylamide Formula: C20H25BrN2O3 MolecularWeight: 421.3281

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2CCCCC2C)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)N[C@H]2CCCC[C@@H]2C)Br)OC

InChI

InChI=1S/C20H25BrN2O3/c1-4-26-18-11-14(10-16(21)19(18)25-3)9-15(12-22)20(24)23-17-8-6-5-7-13(17)2/h9-11,13,17H,4-8H2,1-3H3,(H,23,24)/b15-9+/t13-,17-/m0/s1