3-bromanyl-5-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)benzoic acid

Systemtic Name: 3-bromanyl-5-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)benzoic acid Openeye Name: 4-(2-anilino-2-oxo-ethoxy)-3-bromo-5-methoxy-benzoic acid CAS Name: 4-(2-anilino-2-oxoethoxy)-3-bromo-5-methoxybenzoic acid IUPAC Name: 4-(2-anilino-2-oxoethoxy)-3-bromo-5-methoxybenzoic acid Traditional Name: 4-(2-anilino-2-keto-ethoxy)-3-bromo-5-methoxy-benzoic acid Formula: C16H14BrNO5 MolecularWeight: 380.19006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Br)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Br)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H14BrNO5/c1-22-13-8-10(16(20)21)7-12(17)15(13)23-9-14(19)18-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,19)(H,20,21)