5-(azepan-1-yl)-2-[5-[(4-methoxyphenoxy)methyl]furan-2-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(azepan-1-yl)-2-[5-[(4-methoxyphenoxy)methyl]furan-2-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-[5-[(4-methoxyphenoxy)methyl]-2-furyl]oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-[5-[(4-methoxyphenoxy)methyl]-2-furanyl]-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-[5-[(4-methoxyphenoxy)methyl]furan-2-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-[5-[(4-methoxyphenoxy)methyl]-2-furyl]oxazole-4-carbonitrile Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2=CC=C(O2)C3=NC(=C(O3)N4CCCCCC4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)OCC2=CC=C(O2)C3=NC(=C(O3)N4CCCCCC4)C#N

InChI

InChI=1S/C22H23N3O4/c1-26-16-6-8-17(9-7-16)27-15-18-10-11-20(28-18)21-24-19(14-23)22(29-21)25-12-4-2-3-5-13-25/h6-11H,2-5,12-13,15H2,1H3