1-butyl-3-[4-(2-chloranyl-4-nitro-phenoxy)phenyl]urea

Systemtic Name: 1-butyl-3-[4-(2-chloranyl-4-nitro-phenoxy)phenyl]urea Openeye Name: 1-butyl-3-[4-(2-chloro-4-nitro-phenoxy)phenyl]urea CAS Name: 1-butyl-3-[4-(2-chloro-4-nitrophenoxy)phenyl]urea IUPAC Name: 1-butyl-3-[4-(2-chloro-4-nitrophenoxy)phenyl]urea Traditional Name: 1-butyl-3-[4-(2-chloro-4-nitro-phenoxy)phenyl]urea Formula: C17H18ClN3O4 MolecularWeight: 363.79552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCNC(=O)NC1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H18ClN3O4/c1-2-3-10-19-17(22)20-12-4-7-14(8-5-12)25-16-9-6-13(21(23)24)11-15(16)18/h4-9,11H,2-3,10H2,1H3,(H2,19,20,22)