1-(4-butylphenyl)-3-(4-methyl-3-nitro-phenyl)urea

Systemtic Name: 1-(4-butylphenyl)-3-(4-methyl-3-nitro-phenyl)urea Openeye Name: 1-(4-butylphenyl)-3-(4-methyl-3-nitro-phenyl)urea CAS Name: 1-(4-butylphenyl)-3-(4-methyl-3-nitrophenyl)urea IUPAC Name: 1-(4-butylphenyl)-3-(4-methyl-3-nitrophenyl)urea Traditional Name: 1-(4-butylphenyl)-3-(4-methyl-3-nitro-phenyl)urea Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3/c1-3-4-5-14-7-10-15(11-8-14)19-18(22)20-16-9-6-13(2)17(12-16)21(23)24/h6-12H,3-5H2,1-2H3,(H2,19,20,22)