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2-(4-methoxyphenyl)sulfonyl-2-[(2-nitrophenyl)methylamino]propanoic acid
2-(4-methoxyphenyl)sulfonyl-2-[(2-nitrophenyl)methylamino]propanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC(C(=O)O)(NCC1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)OC
Isomeric SMILES
CC(C(=O)O)(NCC1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)OC
InChI
InChI=1S/C17H18N2O7S/c1-17(16(20)21,18-11-12-5-3-4-6-15(12)19(22)23)27(24,25)14-9-7-13(26-2)8-10-14/h3-10,18H,11H2,1-2H3,(H,20,21)
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