ethyl 4-[2-(bromomethyl)phenyl]sulfonyl-3-chloranyl-4-methyl-2-(methylamino)pentanoate

Systemtic Name: ethyl 4-[2-(bromomethyl)phenyl]sulfonyl-3-chloranyl-4-methyl-2-(methylamino)pentanoate Openeye Name: ethyl 4-[2-(bromomethyl)phenyl]sulfonyl-3-chloro-4-methyl-2-(methylamino)pentanoate CAS Name: 4-[2-(bromomethyl)phenyl]sulfonyl-3-chloro-4-methyl-2-(methylamino)pentanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(bromomethyl)phenyl]sulfonyl-3-chloro-4-methyl-2-(methylamino)pentanoate Traditional Name: 4-[2-(bromomethyl)phenyl]sulfonyl-3-chloro-4-methyl-2-(methylamino)valeric acid ethyl ester Formula: C16H23BrClNO4S MolecularWeight: 440.78012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(C)(C)S(=O)(=O)C1=CC=CC=C1CBr)Cl)NC

Isomeric SMILES

CCOC(=O)C(C(C(C)(C)S(=O)(=O)C1=CC=CC=C1CBr)Cl)NC

InChI

InChI=1S/C16H23BrClNO4S/c1-5-23-15(20)13(19-4)14(18)16(2,3)24(21,22)12-9-7-6-8-11(12)10-17/h6-9,13-14,19H,5,10H2,1-4H3