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ethyl 2-[(4-bromophenyl)sulfonyl-(phenylmethyl)amino]-4-methyl-pentanoate
ethyl 2-[(4-bromophenyl)sulfonyl-(phenylmethyl)amino]-4-methyl-pentanoate
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Descriptors Computed from Structure
Canonical SMILES:
CCOC(=O)C(CC(C)C)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Br
Isomeric SMILES
CCOC(=O)C(CC(C)C)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Br
InChI
InChI=1S/C21H26BrNO4S/c1-4-27-21(24)20(14-16(2)3)23(15-17-8-6-5-7-9-17)28(25,26)19-12-10-18(22)11-13-19/h5-13,16,20H,4,14-15H2,1-3H3
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