ethyl (Z)-4-(5-bromanyl-2-methyl-1-benzofuran-3-yl)-6-(diethylamino)-6-oxidanylidene-hex-4-enoate

Systemtic Name: ethyl (Z)-4-(5-bromanyl-2-methyl-1-benzofuran-3-yl)-6-(diethylamino)-6-oxidanylidene-hex-4-enoate Openeye Name: ethyl (Z)-4-(5-bromo-2-methyl-benzofuran-3-yl)-6-(diethylamino)-6-oxo-hex-4-enoate CAS Name: (Z)-4-(5-bromo-2-methyl-3-benzofuranyl)-6-(diethylamino)-6-oxo-4-hexenoic acid ethyl ester IUPAC Name: ethyl (Z)-4-(5-bromo-2-methyl-1-benzofuran-3-yl)-6-(diethylamino)-6-oxohex-4-enoate Traditional Name: (Z)-4-(5-bromo-2-methyl-benzofuran-3-yl)-6-(diethylamino)-6-keto-hex-4-enoic acid ethyl ester Formula: C21H26BrNO4 MolecularWeight: 436.33944

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C=C(CCC(=O)OCC)C1=C(OC2=C1C=C(C=C2)Br)C

Isomeric SMILES

CCN(CC)C(=O)/C=C(/CCC(=O)OCC)\C1=C(OC2=C1C=C(C=C2)Br)C

InChI

InChI=1S/C21H26BrNO4/c1-5-23(6-2)19(24)12-15(8-11-20(25)26-7-3)21-14(4)27-18-10-9-16(22)13-17(18)21/h9-10,12-13H,5-8,11H2,1-4H3/b15-12-