2-diethylaminoethyl 5-bromanyl-2-oxidanyl-3-phenyl-benzoate

Systemtic Name: 2-diethylaminoethyl 5-bromanyl-2-oxidanyl-3-phenyl-benzoate Openeye Name: 2-diethylaminoethyl 5-bromo-2-hydroxy-3-phenyl-benzoate CAS Name: 5-bromo-2-hydroxy-3-phenylbenzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 5-bromo-2-hydroxy-3-phenylbenzoate Traditional Name: 5-bromo-2-hydroxy-3-phenyl-benzoic acid 2-diethylaminoethyl ester Formula: C19H22BrNO3 MolecularWeight: 392.28688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22BrNO3/c1-3-21(4-2)10-11-24-19(23)17-13-15(20)12-16(18(17)22)14-8-6-5-7-9-14/h5-9,12-13,22H,3-4,10-11H2,1-2H3