1-butyl-3-(7-nitro-2-phenyl-1-benzofuran-3-yl)urea

Systemtic Name: 1-butyl-3-(7-nitro-2-phenyl-1-benzofuran-3-yl)urea Openeye Name: 1-butyl-3-(7-nitro-2-phenyl-benzofuran-3-yl)urea CAS Name: 1-butyl-3-(7-nitro-2-phenyl-3-benzofuranyl)urea IUPAC Name: 1-butyl-3-(7-nitro-2-phenyl-1-benzofuran-3-yl)urea Traditional Name: 1-butyl-3-(7-nitro-2-phenyl-benzofuran-3-yl)urea Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=C(OC2=C1C=CC=C2[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)NC1=C(OC2=C1C=CC=C2[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O4/c1-2-3-12-20-19(23)21-16-14-10-7-11-15(22(24)25)18(14)26-17(16)13-8-5-4-6-9-13/h4-11H,2-3,12H2,1H3,(H2,20,21,23)