(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl (E)-3-[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-2-propenoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(2-amino-2-keto-ethoxy)-3-methoxy-phenyl]acrylic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C22H18BrNO7 MolecularWeight: 488.28482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)OCC(=O)N

InChI

InChI=1S/C22H18BrNO7/c1-28-19-8-13(2-6-17(19)29-12-20(24)25)3-7-21(26)30-11-14-9-22(27)31-18-10-15(23)4-5-16(14)18/h2-10H,11-12H2,1H3,(H2,24,25)/b7-3+