1-methyl-3-(4-propan-2-yloxyphenyl)-1-[2,2,2-tris(bromanyl)-1-butoxy-ethyl]urea

Systemtic Name: 1-methyl-3-(4-propan-2-yloxyphenyl)-1-[2,2,2-tris(bromanyl)-1-butoxy-ethyl]urea Openeye Name: 3-(4-isopropoxyphenyl)-1-methyl-1-(2,2,2-tribromo-1-butoxy-ethyl)urea CAS Name: 1-methyl-3-(4-propan-2-yloxyphenyl)-1-(2,2,2-tribromo-1-butoxyethyl)urea IUPAC Name: 1-methyl-3-(4-propan-2-yloxyphenyl)-1-(2,2,2-tribromo-1-butoxyethyl)urea Traditional Name: 3-(4-isopropoxyphenyl)-1-methyl-1-(2,2,2-tribromo-1-butoxy-ethyl)urea Formula: C17H25Br3N2O3 MolecularWeight: 545.104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C(Br)(Br)Br)N(C)C(=O)NC1=CC=C(C=C1)OC(C)C

Isomeric SMILES

CCCCOC(C(Br)(Br)Br)N(C)C(=O)NC1=CC=C(C=C1)OC(C)C

InChI

InChI=1S/C17H25Br3N2O3/c1-5-6-11-24-15(17(18,19)20)22(4)16(23)21-13-7-9-14(10-8-13)25-12(2)3/h7-10,12,15H,5-6,11H2,1-4H3,(H,21,23)