5-[[(5-bromanyl-2-methoxy-phenyl)methylamino]methyl]-4-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[[(5-bromanyl-2-methoxy-phenyl)methylamino]methyl]-4-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[[(5-bromo-2-methoxy-phenyl)methylamino]methyl]-4-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[(5-bromo-2-methoxyphenyl)methylamino]methyl]-4-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[[(5-bromo-2-methoxyphenyl)methylamino]methyl]-4-methylthiophene-2-carboxylic acid Traditional Name: 5-[[(5-bromo-2-methoxy-benzyl)amino]methyl]-4-methyl-2-thenoic acid Formula: C15H16BrNO3S MolecularWeight: 370.26144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(=O)O)CNCC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC1=C(SC(=C1)C(=O)O)CNCC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C15H16BrNO3S/c1-9-5-13(15(18)19)21-14(9)8-17-7-10-6-11(16)3-4-12(10)20-2/h3-6,17H,7-8H2,1-2H3,(H,18,19)