4-[(4-nitrophenyl)sulfonylamino]-2-phenoxy-pentanoic acid

Systemtic Name: 4-[(4-nitrophenyl)sulfonylamino]-2-phenoxy-pentanoic acid Openeye Name: 4-[(4-nitrophenyl)sulfonylamino]-2-phenoxy-pentanoic acid CAS Name: 4-[(4-nitrophenyl)sulfonylamino]-2-phenoxypentanoic acid IUPAC Name: 4-[(4-nitrophenyl)sulfonylamino]-2-phenoxypentanoic acid Traditional Name: 4-(nosylamino)-2-phenoxy-valeric acid Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(=O)O)OC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(CC(C(=O)O)OC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O7S/c1-12(11-16(17(20)21)26-14-5-3-2-4-6-14)18-27(24,25)15-9-7-13(8-10-15)19(22)23/h2-10,12,16,18H,11H2,1H3,(H,20,21)