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5-[4-[(2-methylpropylazaniumyl)methyl]phenyl]thiophene-2-carboxylate
5-[4-[(2-methylpropylazaniumyl)methyl]phenyl]thiophene-2-carboxylate
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)C[NH2+]CC1=CC=C(C=C1)C2=CC=C(S2)C(=O)[O-]
Isomeric SMILES
CC(C)C[NH2+]CC1=CC=C(C=C1)C2=CC=C(S2)C(=O)[O-]
InChI
InChI=1S/C16H19NO2S/c1-11(2)9-17-10-12-3-5-13(6-4-12)14-7-8-15(20-14)16(18)19/h3-8,11,17H,9-10H2,1-2H3,(H,18,19)
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