5-[[(4-hexoxyphenyl)carbonylamino]carbamoyl]-2-nitro-phenolate

Systemtic Name: 5-[[(4-hexoxyphenyl)carbonylamino]carbamoyl]-2-nitro-phenolate Openeye Name: 5-[[(4-hexoxybenzoyl)amino]carbamoyl]-2-nitro-phenolate CAS Name: 5-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-2-nitrophenolate IUPAC Name: 5-[[(4-hexoxybenzoyl)amino]carbamoyl]-2-nitrophenolate Traditional Name: 5-[[(4-hexoxybenzoyl)amino]carbamoyl]-2-nitro-phenolate Formula: C20H22N3O6- MolecularWeight: 400.40518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C20H23N3O6/c1-2-3-4-5-12-29-16-9-6-14(7-10-16)19(25)21-22-20(26)15-8-11-17(23(27)28)18(24)13-15/h6-11,13,24H,2-5,12H2,1H3,(H,21,25)(H,22,26)/p-1