(E)-N-[[4-(3-bromophenyl)oxan-4-yl]methyl]-3-pyridin-4-yl-prop-2-enamide

Systemtic Name: (E)-N-[[4-(3-bromophenyl)oxan-4-yl]methyl]-3-pyridin-4-yl-prop-2-enamide Openeye Name: (E)-N-[[4-(3-bromophenyl)tetrahydropyran-4-yl]methyl]-3-(4-pyridyl)prop-2-enamide CAS Name: (E)-N-[[4-(3-bromophenyl)-4-oxanyl]methyl]-3-pyridin-4-yl-2-propenamide IUPAC Name: (E)-N-[[4-(3-bromophenyl)oxan-4-yl]methyl]-3-pyridin-4-ylprop-2-enamide Traditional Name: (E)-N-[[4-(3-bromophenyl)tetrahydropyran-4-yl]methyl]-3-(4-pyridyl)acrylamide Formula: C20H21BrN2O2 MolecularWeight: 401.29694

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(CNC(=O)C=CC2=CC=NC=C2)C3=CC(=CC=C3)Br

Isomeric SMILES

C1COCCC1(CNC(=O)/C=C/C2=CC=NC=C2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H21BrN2O2/c21-18-3-1-2-17(14-18)20(8-12-25-13-9-20)15-23-19(24)5-4-16-6-10-22-11-7-16/h1-7,10-11,14H,8-9,12-13,15H2,(H,23,24)/b5-4+