naphthalen-1-ylmethyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: naphthalen-1-ylmethyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: 1-naphthylmethyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid 1-naphthylmethyl ester Formula: C22H20BrNO5S MolecularWeight: 490.3669

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC4=CC=CC=C43)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC4=CC=CC=C43)Br

InChI

InChI=1S/C22H20BrNO5S/c23-20-9-8-17(14-21(20)30(26,27)24-10-12-28-13-11-24)22(25)29-15-18-6-3-5-16-4-1-2-7-19(16)18/h1-9,14H,10-13,15H2