methyl 2-bromanyl-3-[[4-(furan-2-yl)-6-oxidanylidene-cyclohexen-1-yl]amino]benzoate

Systemtic Name: methyl 2-bromanyl-3-[[4-(furan-2-yl)-6-oxidanylidene-cyclohexen-1-yl]amino]benzoate Openeye Name: methyl 2-bromo-3-[[4-(2-furyl)-6-oxo-cyclohexen-1-yl]amino]benzoate CAS Name: 2-bromo-3-[[4-(2-furanyl)-6-oxo-1-cyclohexenyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-bromo-3-[[4-(furan-2-yl)-6-oxocyclohexen-1-yl]amino]benzoate Traditional Name: 2-bromo-3-[[4-(2-furyl)-6-keto-cyclohexen-1-yl]amino]benzoic acid methyl ester Formula: C18H16BrNO4 MolecularWeight: 390.22794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)NC2=CCC(CC2=O)C3=CC=CO3)Br

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)NC2=CCC(CC2=O)C3=CC=CO3)Br

InChI

InChI=1S/C18H16BrNO4/c1-23-18(22)12-4-2-5-14(17(12)19)20-13-8-7-11(10-15(13)21)16-6-3-9-24-16/h2-6,8-9,11,20H,7,10H2,1H3