(2-morpholin-4-yl-2-oxidanylidene-ethyl) (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: (2-morpholino-2-oxo-ethyl) (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-propenoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)acrylic acid (2-keto-2-morpholino-ethyl) ester Formula: C16H18BrNO6 MolecularWeight: 400.22122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)OCC(=O)N2CCOCC2)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)OCC(=O)N2CCOCC2)Br)O

InChI

InChI=1S/C16H18BrNO6/c1-22-13-9-11(8-12(17)16(13)21)2-3-15(20)24-10-14(19)18-4-6-23-7-5-18/h2-3,8-9,21H,4-7,10H2,1H3/b3-2+