(Z)-2-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]-3-morpholin-4-yl-prop-2-enenitrile

Systemtic Name: (Z)-2-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]-3-morpholin-4-yl-prop-2-enenitrile Openeye Name: (Z)-2-[(3-bromo-4,5-dimethoxy-phenyl)methyl]-3-morpholino-prop-2-enenitrile CAS Name: (Z)-2-[(3-bromo-4,5-dimethoxyphenyl)methyl]-3-(4-morpholinyl)-2-propenenitrile IUPAC Name: (Z)-2-[(3-bromo-4,5-dimethoxyphenyl)methyl]-3-morpholin-4-ylprop-2-enenitrile Traditional Name: (Z)-2-(3-bromo-4,5-dimethoxy-benzyl)-3-morpholino-acrylonitrile Formula: C16H19BrN2O3 MolecularWeight: 367.23766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC(=CN2CCOCC2)C#N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C/C(=C/N2CCOCC2)/C#N)Br)OC

InChI

InChI=1S/C16H19BrN2O3/c1-20-15-9-12(8-14(17)16(15)21-2)7-13(10-18)11-19-3-5-22-6-4-19/h8-9,11H,3-7H2,1-2H3/b13-11-