5-bromanyl-2-[2-(2-diethylaminoethylamino)-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-(2-diethylaminoethylamino)-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 5-bromo-2-[2-(2-diethylaminoethylamino)-2-oxo-ethoxy]benzoic acid CAS Name: 5-bromo-2-[2-(2-diethylaminoethylamino)-2-oxoethoxy]benzoic acid IUPAC Name: 5-bromo-2-[2-(2-diethylaminoethylamino)-2-oxoethoxy]benzoic acid Traditional Name: 5-bromo-2-[2-(2-diethylaminoethylamino)-2-keto-ethoxy]benzoic acid Formula: C15H21BrN2O4 MolecularWeight: 373.24224

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)COC1=C(C=C(C=C1)Br)C(=O)O

Isomeric SMILES

CCN(CC)CCNC(=O)COC1=C(C=C(C=C1)Br)C(=O)O

InChI

InChI=1S/C15H21BrN2O4/c1-3-18(4-2)8-7-17-14(19)10-22-13-6-5-11(16)9-12(13)15(20)21/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,17,19)(H,20,21)