1-(4-butylphenyl)-3-(2-methoxy-5-nitro-phenyl)urea

Systemtic Name: 1-(4-butylphenyl)-3-(2-methoxy-5-nitro-phenyl)urea Openeye Name: 1-(4-butylphenyl)-3-(2-methoxy-5-nitro-phenyl)urea CAS Name: 1-(4-butylphenyl)-3-(2-methoxy-5-nitrophenyl)urea IUPAC Name: 1-(4-butylphenyl)-3-(2-methoxy-5-nitrophenyl)urea Traditional Name: 1-(4-butylphenyl)-3-(2-methoxy-5-nitro-phenyl)urea Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C18H21N3O4/c1-3-4-5-13-6-8-14(9-7-13)19-18(22)20-16-12-15(21(23)24)10-11-17(16)25-2/h6-12H,3-5H2,1-2H3,(H2,19,20,22)