7-azanyl-2-[(2-nitrophenyl)sulfonylamino]heptanoic acid

Systemtic Name: 7-azanyl-2-[(2-nitrophenyl)sulfonylamino]heptanoic acid Openeye Name: 7-amino-2-[(2-nitrophenyl)sulfonylamino]heptanoic acid CAS Name: 7-amino-2-[(2-nitrophenyl)sulfonylamino]heptanoic acid IUPAC Name: 7-amino-2-[(2-nitrophenyl)sulfonylamino]heptanoic acid Traditional Name: 7-amino-2-[(2-nitrophenyl)sulfonylamino]enanthic acid Formula: C13H19N3O6S MolecularWeight: 345.37146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O6S/c14-9-5-1-2-6-10(13(17)18)15-23(21,22)12-8-4-3-7-11(12)16(19)20/h3-4,7-8,10,15H,1-2,5-6,9,14H2,(H,17,18)