3-(4-nitrophenyl)-2-[(4-sulfamoylphenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(4-nitrophenyl)-2-[(4-sulfamoylphenyl)carbonylamino]propanoic acid Openeye Name: 3-(4-nitrophenyl)-2-[(4-sulfamoylbenzoyl)amino]propanoic acid CAS Name: 3-(4-nitrophenyl)-2-[[oxo-(4-sulfamoylphenyl)methyl]amino]propanoic acid IUPAC Name: 3-(4-nitrophenyl)-2-[(4-sulfamoylbenzoyl)amino]propanoic acid Traditional Name: 3-(4-nitrophenyl)-2-[(4-sulfamoylbenzoyl)amino]propionic acid Formula: C16H15N3O7S MolecularWeight: 393.3712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O7S/c17-27(25,26)13-7-3-11(4-8-13)15(20)18-14(16(21)22)9-10-1-5-12(6-2-10)19(23)24/h1-8,14H,9H2,(H,18,20)(H,21,22)(H2,17,25,26)