2-(3-ethylphenoxy)ethyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: 2-(3-ethylphenoxy)ethyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: 2-(3-ethylphenoxy)ethyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid 2-(3-ethylphenoxy)ethyl ester IUPAC Name: 2-(3-ethylphenoxy)ethyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid 2-(3-ethylphenoxy)ethyl ester Formula: C21H24BrNO6S MolecularWeight: 498.38736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCCOC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=CC(=CC=C1)OCCOC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H24BrNO6S/c1-2-16-4-3-5-18(14-16)28-12-13-29-21(24)17-6-7-19(22)20(15-17)30(25,26)23-8-10-27-11-9-23/h3-7,14-15H,2,8-13H2,1H3