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

Systemtic Name: ethyl 2-[[4-(bromomethyl)-3-chloranyl-phenyl]sulfonylamino]-4-methyl-pentanoate Openeye Name: ethyl 2-[[4-(bromomethyl)-3-chloro-phenyl]sulfonylamino]-4-methyl-pentanoate CAS Name: 2-[[4-(bromomethyl)-3-chlorophenyl]sulfonylamino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-(bromomethyl)-3-chlorophenyl]sulfonylamino]-4-methylpentanoate Traditional Name: 2-[[4-(bromomethyl)-3-chloro-phenyl]sulfonylamino]-4-methyl-valeric acid ethyl ester Formula: C15H21BrClNO4S MolecularWeight: 426.75354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NS(=O)(=O)C1=CC(=C(C=C1)CBr)Cl

Isomeric SMILES

CCOC(=O)C(CC(C)C)NS(=O)(=O)C1=CC(=C(C=C1)CBr)Cl

InChI

InChI=1S/C15H21BrClNO4S/c1-4-22-15(19)14(7-10(2)3)18-23(20,21)12-6-5-11(9-16)13(17)8-12/h5-6,8,10,14,18H,4,7,9H2,1-3H3