6-azanyl-4-nitro-6-phenoxy-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-azanyl-4-nitro-6-phenoxy-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-amino-4-nitro-6-phenoxy-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-amino-4-nitro-6-phenoxy-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-amino-4-nitro-6-phenoxycyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-amino-4-nitro-6-phenoxy-cyclohexa-2,4-diene-1-carboxylic acid Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2(C=C(C=CC2C(=O)O)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)OC2(C=C(C=CC2C(=O)O)[N+](=O)[O-])N

InChI

InChI=1S/C13H12N2O5/c14-13(20-10-4-2-1-3-5-10)8-9(15(18)19)6-7-11(13)12(16)17/h1-8,11H,14H2,(H,16,17)