ethyl 2-bromanyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: ethyl 2-bromanyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: ethyl 2-bromo-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-bromo-5-(1-piperidinylsulfonyl)benzoic acid ethyl ester IUPAC Name: ethyl 2-bromo-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-bromo-5-piperidinosulfonyl-benzoic acid ethyl ester Formula: C14H18BrNO4S MolecularWeight: 376.26602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Br

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Br

InChI

InChI=1S/C14H18BrNO4S/c1-2-20-14(17)12-10-11(6-7-13(12)15)21(18,19)16-8-4-3-5-9-16/h6-7,10H,2-5,8-9H2,1H3