methyl 5-[(E)-3-[(4-bromanyl-2-chloranyl-phenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[(E)-3-[(4-bromanyl-2-chloranyl-phenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[(E)-3-(4-bromo-2-chloro-anilino)-3-oxo-prop-1-enyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[(E)-3-(4-bromo-2-chloroanilino)-3-oxoprop-1-enyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-3-(4-bromo-2-chloroanilino)-3-oxoprop-1-enyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[(E)-3-(4-bromo-2-chloro-anilino)-3-keto-prop-1-enyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C16H13BrClNO4 MolecularWeight: 398.63572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C=CC(=O)NC2=C(C=C(C=C2)Br)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)/C=C/C(=O)NC2=C(C=C(C=C2)Br)Cl)C(=O)OC

InChI

InChI=1S/C16H13BrClNO4/c1-9-12(16(21)22-2)8-11(23-9)4-6-15(20)19-14-5-3-10(17)7-13(14)18/h3-8H,1-2H3,(H,19,20)/b6-4+