4-[(2-thiophen-2-ylethanoylamino)methyl]benzoic acid

Systemtic Name: 4-[(2-thiophen-2-ylethanoylamino)methyl]benzoic acid Openeye Name: 4-[[[2-(2-thienyl)acetyl]amino]methyl]benzoic acid CAS Name: 4-[[(1-oxo-2-thiophen-2-ylethyl)amino]methyl]benzoic acid IUPAC Name: 4-[[(2-thiophen-2-ylacetyl)amino]methyl]benzoic acid Traditional Name: 4-[[[2-(2-thienyl)acetyl]amino]methyl]benzoic acid Formula: C14H13NO3S MolecularWeight: 275.32292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CSC(=C1)CC(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H13NO3S/c16-13(8-12-2-1-7-19-12)15-9-10-3-5-11(6-4-10)14(17)18/h1-7H,8-9H2,(H,15,16)(H,17,18)