methyl (E)-4-[(2,4-dimethoxyphenyl)methyl-[(4-fluorophenyl)methyl]amino]-4-oxidanyl-2-oxidanylidene-but-3-enoate

Systemtic Name: methyl (E)-4-[(2,4-dimethoxyphenyl)methyl-[(4-fluorophenyl)methyl]amino]-4-oxidanyl-2-oxidanylidene-but-3-enoate Openeye Name: methyl (E)-4-[(2,4-dimethoxyphenyl)methyl-[(4-fluorophenyl)methyl]amino]-4-hydroxy-2-oxo-but-3-enoate CAS Name: (E)-4-[(2,4-dimethoxyphenyl)methyl-[(4-fluorophenyl)methyl]amino]-4-hydroxy-2-oxo-3-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[(2,4-dimethoxyphenyl)methyl-[(4-fluorophenyl)methyl]amino]-4-hydroxy-2-oxobut-3-enoate Traditional Name: (E)-4-[(2,4-dimethoxybenzyl)-(4-fluorobenzyl)amino]-4-hydroxy-2-keto-but-3-enoic acid methyl ester Formula: C21H22FNO6 MolecularWeight: 403.400883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN(CC2=CC=C(C=C2)F)C(=CC(=O)C(=O)OC)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(CC2=CC=C(C=C2)F)/C(=C\C(=O)C(=O)OC)/O)OC

InChI

InChI=1S/C21H22FNO6/c1-27-17-9-6-15(19(10-17)28-2)13-23(12-14-4-7-16(22)8-5-14)20(25)11-18(24)21(26)29-3/h4-11,25H,12-13H2,1-3H3/b20-11+