3-(3-nitrophenyl)-3-(thiophen-2-ylcarbonylamino)propanoic acid

Systemtic Name: 3-(3-nitrophenyl)-3-(thiophen-2-ylcarbonylamino)propanoic acid Openeye Name: 3-(3-nitrophenyl)-3-(thiophene-2-carbonylamino)propanoic acid CAS Name: 3-(3-nitrophenyl)-3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid IUPAC Name: 3-(3-nitrophenyl)-3-(thiophene-2-carbonylamino)propanoic acid Traditional Name: 3-(3-nitrophenyl)-3-(2-thenoylamino)propionic acid Formula: C14H12N2O5S MolecularWeight: 320.32048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(CC(=O)O)NC(=O)C2=CC=CS2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(CC(=O)O)NC(=O)C2=CC=CS2

InChI

InChI=1S/C14H12N2O5S/c17-13(18)8-11(15-14(19)12-5-2-6-22-12)9-3-1-4-10(7-9)16(20)21/h1-7,11H,8H2,(H,15,19)(H,17,18)