ethyl 4-(5-bromanyl-2-methyl-phenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(5-bromanyl-2-methyl-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(5-bromo-2-methyl-phenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(5-bromo-2-methylphenyl)sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-bromo-2-methylphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(5-bromo-2-methyl-phenyl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C14H19BrN2O4S MolecularWeight: 391.28066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Br)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Br)C

InChI

InChI=1S/C14H19BrN2O4S/c1-3-21-14(18)16-6-8-17(9-7-16)22(19,20)13-10-12(15)5-4-11(13)2/h4-5,10H,3,6-9H2,1-2H3