4-(5-azanyl-2-chloranyl-4-nitro-phenyl)piperazine-2-carboxylic acid

Systemtic Name: 4-(5-azanyl-2-chloranyl-4-nitro-phenyl)piperazine-2-carboxylic acid Openeye Name: 4-(5-amino-2-chloro-4-nitro-phenyl)piperazine-2-carboxylic acid CAS Name: 4-(5-amino-2-chloro-4-nitrophenyl)-2-piperazinecarboxylic acid IUPAC Name: 4-(5-amino-2-chloro-4-nitrophenyl)piperazine-2-carboxylic acid Traditional Name: 4-(5-amino-2-chloro-4-nitro-phenyl)piperazine-2-carboxylic acid Formula: C11H13ClN4O4 MolecularWeight: 300.69832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)C(=O)O)C2=CC(=C(C=C2Cl)[N+](=O)[O-])N

Isomeric SMILES

C1CN(CC(N1)C(=O)O)C2=CC(=C(C=C2Cl)[N+](=O)[O-])N

InChI

InChI=1S/C11H13ClN4O4/c12-6-3-10(16(19)20)7(13)4-9(6)15-2-1-14-8(5-15)11(17)18/h3-4,8,14H,1-2,5,13H2,(H,17,18)