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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1(CN(CCN1C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

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