(E)-3-(2-bromophenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide

Systemtic Name: (E)-3-(2-bromophenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Openeye Name: (E)-3-(2-bromophenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide CAS Name: (E)-3-(2-bromophenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-2-propenamide IUPAC Name: (E)-3-(2-bromophenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Traditional Name: (E)-3-(2-bromophenyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]acrylamide Formula: C17H19BrN2O MolecularWeight: 347.24956

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(=CC2=CC=CC=C2Br)C#N

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)/C(=C/C2=CC=CC=C2Br)/C#N

InChI

InChI=1S/C17H19BrN2O/c1-12-6-2-5-9-16(12)20-17(21)14(11-19)10-13-7-3-4-8-15(13)18/h3-4,7-8,10,12,16H,2,5-6,9H2,1H3,(H,20,21)/b14-10+/t12-,16-/m0/s1