1-[1-(3-bromophenyl)ethyl]-3-(2-methyl-3-nitro-phenyl)urea

Systemtic Name: 1-[1-(3-bromophenyl)ethyl]-3-(2-methyl-3-nitro-phenyl)urea Openeye Name: 1-[1-(3-bromophenyl)ethyl]-3-(2-methyl-3-nitro-phenyl)urea CAS Name: 1-[1-(3-bromophenyl)ethyl]-3-(2-methyl-3-nitrophenyl)urea IUPAC Name: 1-[1-(3-bromophenyl)ethyl]-3-(2-methyl-3-nitrophenyl)urea Traditional Name: 1-[1-(3-bromophenyl)ethyl]-3-(2-methyl-3-nitro-phenyl)urea Formula: C16H16BrN3O3 MolecularWeight: 378.22054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)NC(C)C2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)NC(C)C2=CC(=CC=C2)Br

InChI

InChI=1S/C16H16BrN3O3/c1-10-14(7-4-8-15(10)20(22)23)19-16(21)18-11(2)12-5-3-6-13(17)9-12/h3-9,11H,1-2H3,(H2,18,19,21)