4-nitro-2-[[[4-(2-oxidanylidenepiperidin-1-yl)phenyl]carbonylamino]methyl]phenolate

Systemtic Name: 4-nitro-2-[[[4-(2-oxidanylidenepiperidin-1-yl)phenyl]carbonylamino]methyl]phenolate Openeye Name: 4-nitro-2-[[[4-(2-oxo-1-piperidyl)benzoyl]amino]methyl]phenolate CAS Name: 4-nitro-2-[[[oxo-[4-(2-oxo-1-piperidinyl)phenyl]methyl]amino]methyl]phenolate IUPAC Name: 4-nitro-2-[[[4-(2-oxopiperidin-1-yl)benzoyl]amino]methyl]phenolate Traditional Name: 2-[[[4-(2-ketopiperidino)benzoyl]amino]methyl]-4-nitro-phenolate Formula: C19H18N3O5- MolecularWeight: 368.36332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=CC=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1CCN(C(=O)C1)C2=CC=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H19N3O5/c23-17-9-8-16(22(26)27)11-14(17)12-20-19(25)13-4-6-15(7-5-13)21-10-2-1-3-18(21)24/h4-9,11,23H,1-3,10,12H2,(H,20,25)/p-1