2-[[(4-ethoxy-3-methoxy-phenyl)carbonylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[(4-ethoxy-3-methoxy-phenyl)carbonylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[(4-ethoxy-3-methoxy-benzoyl)amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[(4-ethoxy-3-methoxyphenyl)-oxomethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[(4-ethoxy-3-methoxybenzoyl)amino]methyl]-4-nitrophenolate Traditional Name: 2-[[(4-ethoxy-3-methoxy-benzoyl)amino]methyl]-4-nitro-phenolate Formula: C17H17N2O6- MolecularWeight: 345.32668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])OC

InChI

InChI=1S/C17H18N2O6/c1-3-25-15-7-4-11(9-16(15)24-2)17(21)18-10-12-8-13(19(22)23)5-6-14(12)20/h4-9,20H,3,10H2,1-2H3,(H,18,21)/p-1