1-(3-nitrophenyl)cyclohexane-1-carboxylic acid

Systemtic Name: 1-(3-nitrophenyl)cyclohexane-1-carboxylic acid Openeye Name: 1-(3-nitrophenyl)cyclohexanecarboxylic acid CAS Name: 1-(3-nitrophenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 1-(3-nitrophenyl)cyclohexane-1-carboxylic acid Traditional Name: 1-(3-nitrophenyl)cyclohexanecarboxylic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CCC(CC1)(C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H15NO4/c15-12(16)13(7-2-1-3-8-13)10-5-4-6-11(9-10)14(17)18/h4-6,9H,1-3,7-8H2,(H,15,16)