1-(4-butan-2-ylphenyl)-3-(4-methyl-3-nitro-phenyl)urea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(4-methyl-3-nitro-phenyl)urea Openeye Name: 1-(4-methyl-3-nitro-phenyl)-3-(4-sec-butylphenyl)urea CAS Name: 1-(4-butan-2-ylphenyl)-3-(4-methyl-3-nitrophenyl)urea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(4-methyl-3-nitrophenyl)urea Traditional Name: 1-(4-methyl-3-nitro-phenyl)-3-(4-sec-butylphenyl)urea Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3/c1-4-12(2)14-6-9-15(10-7-14)19-18(22)20-16-8-5-13(3)17(11-16)21(23)24/h5-12H,4H2,1-3H3,(H2,19,20,22)