methyl 2-[(5-bromanyl-2-methoxy-phenyl)sulfonyl-(2-ethylbutyl)amino]ethanoate

Systemtic Name: methyl 2-[(5-bromanyl-2-methoxy-phenyl)sulfonyl-(2-ethylbutyl)amino]ethanoate Openeye Name: methyl 2-[(5-bromo-2-methoxy-phenyl)sulfonyl-(2-ethylbutyl)amino]acetate CAS Name: 2-[(5-bromo-2-methoxyphenyl)sulfonyl-(2-ethylbutyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-2-methoxyphenyl)sulfonyl-(2-ethylbutyl)amino]acetate Traditional Name: 2-[(5-bromo-2-methoxy-phenyl)sulfonyl-(2-ethylbutyl)amino]acetic acid methyl ester Formula: C16H24BrNO5S MolecularWeight: 422.33446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CN(CC(=O)OC)S(=O)(=O)C1=C(C=CC(=C1)Br)OC

Isomeric SMILES

CCC(CC)CN(CC(=O)OC)S(=O)(=O)C1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C16H24BrNO5S/c1-5-12(6-2)10-18(11-16(19)23-4)24(20,21)15-9-13(17)7-8-14(15)22-3/h7-9,12H,5-6,10-11H2,1-4H3