2,6-dimethyl-4-(4-nitrophenyl)piperazine-1-carboxylic acid

Systemtic Name: 2,6-dimethyl-4-(4-nitrophenyl)piperazine-1-carboxylic acid Openeye Name: 2,6-dimethyl-4-(4-nitrophenyl)piperazine-1-carboxylic acid CAS Name: 2,6-dimethyl-4-(4-nitrophenyl)-1-piperazinecarboxylic acid IUPAC Name: 2,6-dimethyl-4-(4-nitrophenyl)piperazine-1-carboxylic acid Traditional Name: 2,6-dimethyl-4-(4-nitrophenyl)piperazine-1-carboxylic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C(=O)O)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(N1C(=O)O)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O4/c1-9-7-14(8-10(2)15(9)13(17)18)11-3-5-12(6-4-11)16(19)20/h3-6,9-10H,7-8H2,1-2H3,(H,17,18)