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

Systemtic Name: 4-nitro-2-[[[4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylamino]methyl]phenolate Openeye Name: 4-nitro-2-[[[4-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]methyl]phenolate CAS Name: 4-nitro-2-[[[oxo-[4-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]amino]methyl]phenolate IUPAC Name: 4-nitro-2-[[[4-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]methyl]phenolate Traditional Name: 2-[[[4-[(2-ketopyrrolidino)methyl]benzoyl]amino]methyl]-4-nitro-phenolate Formula: C19H18N3O5- MolecularWeight: 368.36332

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H19N3O5/c23-17-8-7-16(22(26)27)10-15(17)11-20-19(25)14-5-3-13(4-6-14)12-21-9-1-2-18(21)24/h3-8,10,23H,1-2,9,11-12H2,(H,20,25)/p-1