3-cyanopropyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: 3-cyanopropyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: 3-cyanopropyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid 3-cyanopropyl ester Formula: C15H17BrN2O5S MolecularWeight: 417.27488

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCCC#N)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCCC#N)Br

InChI

InChI=1S/C15H17BrN2O5S/c16-13-4-3-12(15(19)23-8-2-1-5-17)11-14(13)24(20,21)18-6-9-22-10-7-18/h3-4,11H,1-2,6-10H2