5-[[(4-ethoxy-3-methoxy-phenyl)methylamino]methyl]-4-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[[(4-ethoxy-3-methoxy-phenyl)methylamino]methyl]-4-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[[(4-ethoxy-3-methoxy-phenyl)methylamino]methyl]-4-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[(4-ethoxy-3-methoxyphenyl)methylamino]methyl]-4-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[[(4-ethoxy-3-methoxyphenyl)methylamino]methyl]-4-methylthiophene-2-carboxylic acid Traditional Name: 5-[[(4-ethoxy-3-methoxy-benzyl)amino]methyl]-4-methyl-2-thenoic acid Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNCC2=C(C=C(S2)C(=O)O)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNCC2=C(C=C(S2)C(=O)O)C)OC

InChI

InChI=1S/C17H21NO4S/c1-4-22-13-6-5-12(8-14(13)21-3)9-18-10-16-11(2)7-15(23-16)17(19)20/h5-8,18H,4,9-10H2,1-3H3,(H,19,20)