2-nitro-5-[1-(oxolan-2-yl)ethylamino]benzoic acid

Systemtic Name: 2-nitro-5-[1-(oxolan-2-yl)ethylamino]benzoic acid Openeye Name: 2-nitro-5-(1-tetrahydrofuran-2-ylethylamino)benzoic acid CAS Name: 2-nitro-5-[1-(2-oxolanyl)ethylamino]benzoic acid IUPAC Name: 2-nitro-5-[1-(oxolan-2-yl)ethylamino]benzoic acid Traditional Name: 2-nitro-5-[1-(tetrahydrofuryl)ethylamino]benzoic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCO1)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C1CCCO1)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H16N2O5/c1-8(12-3-2-6-20-12)14-9-4-5-11(15(18)19)10(7-9)13(16)17/h4-5,7-8,12,14H,2-3,6H2,1H3,(H,16,17)