3-[2-(1,3-benzodioxol-5-yl)ethyl]-1,1-bis(2-bromoethyl)urea

Systemtic Name: 3-[2-(1,3-benzodioxol-5-yl)ethyl]-1,1-bis(2-bromoethyl)urea Openeye Name: 3-[2-(1,3-benzodioxol-5-yl)ethyl]-1,1-bis(2-bromoethyl)urea CAS Name: 3-[2-(1,3-benzodioxol-5-yl)ethyl]-1,1-bis(2-bromoethyl)urea IUPAC Name: 3-[2-(1,3-benzodioxol-5-yl)ethyl]-1,1-bis(2-bromoethyl)urea Traditional Name: 1,1-bis(2-bromoethyl)-3-homopiperonyl-urea Formula: C14H18Br2N2O3 MolecularWeight: 422.11232

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)N(CCBr)CCBr

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)N(CCBr)CCBr

InChI

InChI=1S/C14H18Br2N2O3/c15-4-7-18(8-5-16)14(19)17-6-3-11-1-2-12-13(9-11)21-10-20-12/h1-2,9H,3-8,10H2,(H,17,19)