1,3-bis(4-nitrophenyl)urea; 1-methylpyrrolidin-2-one

Systemtic Name: 1,3-bis(4-nitrophenyl)urea; 1-methylpyrrolidin-2-one Openeye Name: 1,3-bis(4-nitrophenyl)urea; 1-methylpyrrolidin-2-one CAS Name: 1,3-bis(4-nitrophenyl)urea; 1-methyl-2-pyrrolidinone IUPAC Name: 1,3-bis(4-nitrophenyl)urea; 1-methylpyrrolidin-2-one Traditional Name: 1,3-bis(4-nitrophenyl)urea; 1-methyl-2-pyrrolidone Formula: C18H19N5O6 MolecularWeight: 401.37336

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1=O.C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1CCCC1=O.C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O5.C5H9NO/c18-13(14-9-1-5-11(6-2-9)16(19)20)15-10-3-7-12(8-4-10)17(21)22;1-6-4-2-3-5(6)7/h1-8H,(H2,14,15,18);2-4H2,1H3