5-(3-methylmorpholin-4-yl)-2-nitro-benzoic acid

Systemtic Name: 5-(3-methylmorpholin-4-yl)-2-nitro-benzoic acid Openeye Name: 5-(3-methylmorpholin-4-yl)-2-nitro-benzoic acid CAS Name: 5-(3-methyl-4-morpholinyl)-2-nitrobenzoic acid IUPAC Name: 5-(3-methylmorpholin-4-yl)-2-nitrobenzoic acid Traditional Name: 5-(3-methylmorpholino)-2-nitro-benzoic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCCN1C2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1COCCN1C2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H14N2O5/c1-8-7-19-5-4-13(8)9-2-3-11(14(17)18)10(6-9)12(15)16/h2-3,6,8H,4-5,7H2,1H3,(H,15,16)