methyl 2-[1-[2-bromanylethanoyl(3-phenylmethoxypropyl)amino]cyclopropyl]-2-chloranyl-ethanoate

Systemtic Name: methyl 2-[1-[2-bromanylethanoyl(3-phenylmethoxypropyl)amino]cyclopropyl]-2-chloranyl-ethanoate Openeye Name: methyl 2-[1-[3-benzyloxypropyl-(2-bromoacetyl)amino]cyclopropyl]-2-chloro-acetate CAS Name: 2-[1-[(2-bromo-1-oxoethyl)-(3-phenylmethoxypropyl)amino]cyclopropyl]-2-chloroacetic acid methyl ester IUPAC Name: methyl 2-[1-[(2-bromoacetyl)-(3-phenylmethoxypropyl)amino]cyclopropyl]-2-chloroacetate Traditional Name: 2-[1-[3-benzoxypropyl-(2-bromoacetyl)amino]cyclopropyl]-2-chloro-acetic acid methyl ester Formula: C18H23BrClNO4 MolecularWeight: 432.73652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1(CC1)N(CCCOCC2=CC=CC=C2)C(=O)CBr)Cl

Isomeric SMILES

COC(=O)C(C1(CC1)N(CCCOCC2=CC=CC=C2)C(=O)CBr)Cl

InChI

InChI=1S/C18H23BrClNO4/c1-24-17(23)16(20)18(8-9-18)21(15(22)12-19)10-5-11-25-13-14-6-3-2-4-7-14/h2-4,6-7,16H,5,8-13H2,1H3