1-phenylethyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: 1-phenylethyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: 1-phenylethyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid 1-phenylethyl ester IUPAC Name: 1-phenylethyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid 1-phenylethyl ester Formula: C19H20BrNO5S MolecularWeight: 454.3348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H20BrNO5S/c1-14(15-5-3-2-4-6-15)26-19(22)16-7-8-17(20)18(13-16)27(23,24)21-9-11-25-12-10-21/h2-8,13-14H,9-12H2,1H3