2-[furan-2-ylmethyl(methyl)amino]-5-nitro-benzoic acid

Systemtic Name: 2-[furan-2-ylmethyl(methyl)amino]-5-nitro-benzoic acid Openeye Name: 2-[2-furylmethyl(methyl)amino]-5-nitro-benzoic acid CAS Name: 2-[2-furanylmethyl(methyl)amino]-5-nitrobenzoic acid IUPAC Name: 2-[furan-2-ylmethyl(methyl)amino]-5-nitrobenzoic acid Traditional Name: 2-[2-furfuryl(methyl)amino]-5-nitro-benzoic acid Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CO1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CN(CC1=CC=CO1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H12N2O5/c1-14(8-10-3-2-6-20-10)12-5-4-9(15(18)19)7-11(12)13(16)17/h2-7H,8H2,1H3,(H,16,17)