methyl 4-[2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxoethoxy]benzoate Traditional Name: 4-[2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C18H16BrNO6 MolecularWeight: 422.22674

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C18H16BrNO6/c1-23-18(22)11-2-4-12(5-3-11)26-10-17(21)20-14-9-16-15(8-13(14)19)24-6-7-25-16/h2-5,8-9H,6-7,10H2,1H3,(H,20,21)