3-bromanyl-4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-5-methoxy-benzoic acid

Systemtic Name: 3-bromanyl-4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-5-methoxy-benzoic acid Openeye Name: 3-bromo-4-[2-(tert-butylamino)-2-oxo-ethoxy]-5-methoxy-benzoic acid CAS Name: 3-bromo-4-[2-(tert-butylamino)-2-oxoethoxy]-5-methoxybenzoic acid IUPAC Name: 3-bromo-4-[2-(tert-butylamino)-2-oxoethoxy]-5-methoxybenzoic acid Traditional Name: 3-bromo-4-[2-(tert-butylamino)-2-keto-ethoxy]-5-methoxy-benzoic acid Formula: C14H18BrNO5 MolecularWeight: 360.20042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=C(C=C(C=C1Br)C(=O)O)OC

Isomeric SMILES

CC(C)(C)NC(=O)COC1=C(C=C(C=C1Br)C(=O)O)OC

InChI

InChI=1S/C14H18BrNO5/c1-14(2,3)16-11(17)7-21-12-9(15)5-8(13(18)19)6-10(12)20-4/h5-6H,7H2,1-4H3,(H,16,17)(H,18,19)