2-diethylaminoethyl 4-[(5-bromanyl-2-oxidanyl-phenyl)carbonylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[(5-bromanyl-2-oxidanyl-phenyl)carbonylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[(5-bromo-2-hydroxy-benzoyl)amino]benzoate CAS Name: 4-[[(5-bromo-2-hydroxyphenyl)-oxomethyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[(5-bromo-2-hydroxybenzoyl)amino]benzoate Traditional Name: 4-[(5-bromo-2-hydroxy-benzoyl)amino]benzoic acid 2-diethylaminoethyl ester Formula: C20H23BrN2O4 MolecularWeight: 435.31162

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Br)O

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C20H23BrN2O4/c1-3-23(4-2)11-12-27-20(26)14-5-8-16(9-6-14)22-19(25)17-13-15(21)7-10-18(17)24/h5-10,13,24H,3-4,11-12H2,1-2H3,(H,22,25)