N-[4-[5-(1,4-diazepan-1-ylcarbonyl)furan-2-yl]phenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[4-[5-(1,4-diazepan-1-ylcarbonyl)furan-2-yl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[4-[5-(1,4-diazepane-1-carbonyl)-2-furyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[4-[5-[1,4-diazepan-1-yl(oxo)methyl]-2-furanyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[4-[5-(1,4-diazepane-1-carbonyl)furan-2-yl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[4-[5-(1,4-diazepane-1-carbonyl)-2-furyl]phenyl]-3,4-dimethoxy-benzamide Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=CC=C(O3)C(=O)N4CCCNCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=CC=C(O3)C(=O)N4CCCNCC4)OC

InChI

InChI=1S/C25H27N3O5/c1-31-21-9-6-18(16-23(21)32-2)24(29)27-19-7-4-17(5-8-19)20-10-11-22(33-20)25(30)28-14-3-12-26-13-15-28/h4-11,16,26H,3,12-15H2,1-2H3,(H,27,29)