4-methyl-1-(2-nitrophenyl)piperazine-2-carboxylic acid

Systemtic Name: 4-methyl-1-(2-nitrophenyl)piperazine-2-carboxylic acid Openeye Name: 4-methyl-1-(2-nitrophenyl)piperazine-2-carboxylic acid CAS Name: 4-methyl-1-(2-nitrophenyl)-2-piperazinecarboxylic acid IUPAC Name: 4-methyl-1-(2-nitrophenyl)piperazine-2-carboxylic acid Traditional Name: 4-methyl-1-(2-nitrophenyl)piperazine-2-carboxylic acid Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C(=O)O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CN1CCN(C(C1)C(=O)O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O4/c1-13-6-7-14(11(8-13)12(16)17)9-4-2-3-5-10(9)15(18)19/h2-5,11H,6-8H2,1H3,(H,16,17)