1-[(2-bromanyl-4,5-dimethoxy-phenyl)-(furan-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)-(furan-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(2-furyl)methyl]-1,4-diazepane CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-(2-furanyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-(furan-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(2-furyl)methyl]-1,4-diazepane Formula: C18H23BrN2O3 MolecularWeight: 395.29082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(C2=CC=CO2)N3CCCNCC3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(C2=CC=CO2)N3CCCNCC3)Br)OC

InChI

InChI=1S/C18H23BrN2O3/c1-22-16-11-13(14(19)12-17(16)23-2)18(15-5-3-10-24-15)21-8-4-6-20-7-9-21/h3,5,10-12,18,20H,4,6-9H2,1-2H3