4-(morpholin-4-ylmethyl)-2-nitro-benzoic acid

Systemtic Name: 4-(morpholin-4-ylmethyl)-2-nitro-benzoic acid Openeye Name: 4-(morpholinomethyl)-2-nitro-benzoic acid CAS Name: 4-(4-morpholinylmethyl)-2-nitrobenzoic acid IUPAC Name: 4-(morpholin-4-ylmethyl)-2-nitrobenzoic acid Traditional Name: 4-(morpholinomethyl)-2-nitro-benzoic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC(=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CC2=CC(=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5/c15-12(16)10-2-1-9(7-11(10)14(17)18)8-13-3-5-19-6-4-13/h1-2,7H,3-6,8H2,(H,15,16)