N-cyclohexyl-2-methoxy-5-nitro-aniline; ethanedioic acid

Systemtic Name: N-cyclohexyl-2-methoxy-5-nitro-aniline; ethanedioic acid Openeye Name: N-cyclohexyl-2-methoxy-5-nitro-aniline; oxalic acid CAS Name: N-cyclohexyl-2-methoxy-5-nitroaniline; oxalic acid IUPAC Name: N-cyclohexyl-2-methoxy-5-nitroaniline; oxalic acid Traditional Name: cyclohexyl-(2-methoxy-5-nitro-phenyl)amine; oxalic acid Formula: C15H20N2O7 MolecularWeight: 340.3285

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2CCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2CCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H18N2O3.C2H2O4/c1-18-13-8-7-11(15(16)17)9-12(13)14-10-5-3-2-4-6-10;3-1(4)2(5)6/h7-10,14H,2-6H2,1H3;(H,3,4)(H,5,6)