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

Systemtic Name: 1-cyanoethyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: 1-cyanoethyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid 1-cyanoethyl ester Formula: C14H15BrN2O5S MolecularWeight: 403.2483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(C#N)OC(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C14H15BrN2O5S/c1-10(9-16)22-14(18)11-2-3-12(15)13(8-11)23(19,20)17-4-6-21-7-5-17/h2-3,8,10H,4-7H2,1H3