2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-chloranyl-phenyl]-1,3-diazinane

Systemtic Name: 2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-chloranyl-phenyl]-1,3-diazinane Openeye Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-chloro-phenyl]hexahydropyrimidine CAS Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-chlorophenyl]-1,3-diazinane IUPAC Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-chlorophenyl]-1,3-diazinane Traditional Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-chloro-phenyl]hexahydropyrimidine Formula: C19H22BrClN2O MolecularWeight: 409.74778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CCC2=C(C=CC=C2Cl)C3NCCCN3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CCC2=C(C=CC=C2Cl)C3NCCCN3

InChI

InChI=1S/C19H22BrClN2O/c1-24-18-9-7-14(20)12-13(18)6-8-15-16(4-2-5-17(15)21)19-22-10-3-11-23-19/h2,4-5,7,9,12,19,22-23H,3,6,8,10-11H2,1H3