2-[furan-2-ylmethyl-(3-nitrophenyl)sulfonyl-amino]benzoate

Systemtic Name: 2-[furan-2-ylmethyl-(3-nitrophenyl)sulfonyl-amino]benzoate Openeye Name: 2-[2-furylmethyl-(3-nitrophenyl)sulfonyl-amino]benzoate CAS Name: 2-[2-furanylmethyl-(3-nitrophenyl)sulfonylamino]benzoate IUPAC Name: 2-[furan-2-ylmethyl-(3-nitrophenyl)sulfonylamino]benzoate Traditional Name: 2-[2-furfuryl-(3-nitrophenyl)sulfonyl-amino]benzoate Formula: C18H13N2O7S- MolecularWeight: 401.37002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])N(CC2=CC=CO2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])N(CC2=CC=CO2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O7S/c21-18(22)16-8-1-2-9-17(16)19(12-14-6-4-10-27-14)28(25,26)15-7-3-5-13(11-15)20(23)24/h1-11H,12H2,(H,21,22)/p-1