1-[(3,4-dimethoxyphenyl)-(furan-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-(furan-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(3,4-dimethoxyphenyl)-(2-furyl)methyl]-1,4-diazepane CAS Name: 1-[(3,4-dimethoxyphenyl)-(2-furanyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,4-dimethoxyphenyl)-(furan-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(3,4-dimethoxyphenyl)-(2-furyl)methyl]-1,4-diazepane Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O3/c1-21-15-7-6-14(13-17(15)22-2)18(16-5-3-12-23-16)20-10-4-8-19-9-11-20/h3,5-7,12-13,18-19H,4,8-11H2,1-2H3