4-[[[4-(thiophen-2-ylmethoxy)phenyl]methylamino]methyl]benzoic acid

Systemtic Name: 4-[[[4-(thiophen-2-ylmethoxy)phenyl]methylamino]methyl]benzoic acid Openeye Name: 4-[[[4-(2-thienylmethoxy)phenyl]methylamino]methyl]benzoic acid CAS Name: 4-[[[4-(thiophen-2-ylmethoxy)phenyl]methylamino]methyl]benzoic acid IUPAC Name: 4-[[[4-(thiophen-2-ylmethoxy)phenyl]methylamino]methyl]benzoic acid Traditional Name: 4-[[[4-(2-thenyloxy)benzyl]amino]methyl]benzoic acid Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)COC2=CC=C(C=C2)CNCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CSC(=C1)COC2=CC=C(C=C2)CNCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H19NO3S/c22-20(23)17-7-3-15(4-8-17)12-21-13-16-5-9-18(10-6-16)24-14-19-2-1-11-25-19/h1-11,21H,12-14H2,(H,22,23)