4-[5-[4-(aminomethyl)-5-ethanoyl-2-oxidanylidene-1,3-oxazolidin-3-yl]thiophen-2-yl]benzoic acid

Systemtic Name: 4-[5-[4-(aminomethyl)-5-ethanoyl-2-oxidanylidene-1,3-oxazolidin-3-yl]thiophen-2-yl]benzoic acid Openeye Name: 4-[5-[5-acetyl-4-(aminomethyl)-2-oxo-oxazolidin-3-yl]-2-thienyl]benzoic acid CAS Name: 4-[5-[5-acetyl-4-(aminomethyl)-2-oxo-3-oxazolidinyl]-2-thiophenyl]benzoic acid IUPAC Name: 4-[5-[5-acetyl-4-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]thiophen-2-yl]benzoic acid Traditional Name: 4-[5-[5-acetyl-4-(aminomethyl)-2-keto-oxazolidin-3-yl]-2-thienyl]benzoic acid Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(N(C(=O)O1)C2=CC=C(S2)C3=CC=C(C=C3)C(=O)O)CN

Isomeric SMILES

CC(=O)C1C(N(C(=O)O1)C2=CC=C(S2)C3=CC=C(C=C3)C(=O)O)CN

InChI

InChI=1S/C17H16N2O5S/c1-9(20)15-12(8-18)19(17(23)24-15)14-7-6-13(25-14)10-2-4-11(5-3-10)16(21)22/h2-7,12,15H,8,18H2,1H3,(H,21,22)