methyl 2-[[(4-bromophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-bromophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[(4-bromophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[(4-bromophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-bromophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[brosyl(3-methoxypropyl)amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C16H19BrN2O6S MolecularWeight: 447.30086

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=NC(=CO1)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COCCCN(CC1=NC(=CO1)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H19BrN2O6S/c1-23-9-3-8-19(10-15-18-14(11-25-15)16(20)24-2)26(21,22)13-6-4-12(17)5-7-13/h4-7,11H,3,8-10H2,1-2H3