1,4-bis(azanyl)-3,6-bis(oxidanylidene)-2-phenyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1,4-bis(azanyl)-3,6-bis(oxidanylidene)-2-phenyl-cyclohexane-1-carboxylic acid Openeye Name: 1,4-diamino-3,6-dioxo-2-phenyl-cyclohexanecarboxylic acid CAS Name: 1,4-diamino-3,6-dioxo-2-phenyl-1-cyclohexanecarboxylic acid IUPAC Name: 1,4-diamino-3,6-dioxo-2-phenylcyclohexane-1-carboxylic acid Traditional Name: 1,4-diamino-3,6-diketo-2-phenyl-cyclohexanecarboxylic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C(C(C1=O)(C(=O)O)N)C2=CC=CC=C2)N

Isomeric SMILES

C1C(C(=O)C(C(C1=O)(C(=O)O)N)C2=CC=CC=C2)N

InChI

InChI=1S/C13H14N2O4/c14-8-6-9(16)13(15,12(18)19)10(11(8)17)7-4-2-1-3-5-7/h1-5,8,10H,6,14-15H2,(H,18,19)