5-[5-(3-azanyl-4-ethanoyl-2-propyl-phenoxy)pentoxy]-2-(oxan-2-yloxymethyl)pyran-4-one

Systemtic Name: 5-[5-(3-azanyl-4-ethanoyl-2-propyl-phenoxy)pentoxy]-2-(oxan-2-yloxymethyl)pyran-4-one Openeye Name: 5-[5-(4-acetyl-3-amino-2-propyl-phenoxy)pentoxy]-2-(tetrahydropyran-2-yloxymethyl)pyran-4-one CAS Name: 5-[5-(4-acetyl-3-amino-2-propylphenoxy)pentoxy]-2-(2-oxanyloxymethyl)-4-pyranone IUPAC Name: 5-[5-(4-acetyl-3-amino-2-propylphenoxy)pentoxy]-2-(oxan-2-yloxymethyl)pyran-4-one Traditional Name: 5-[5-(4-acetyl-3-amino-2-propyl-phenoxy)pentoxy]-2-(tetrahydropyran-2-yloxymethyl)pyran-4-one Formula: C27H37NO7 MolecularWeight: 487.58518

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1N)C(=O)C)OCCCCCOC2=COC(=CC2=O)COC3CCCCO3

Isomeric SMILES

CCCC1=C(C=CC(=C1N)C(=O)C)OCCCCCOC2=COC(=CC2=O)COC3CCCCO3

InChI

InChI=1S/C27H37NO7/c1-3-9-22-24(12-11-21(19(2)29)27(22)28)31-13-6-4-7-14-32-25-18-34-20(16-23(25)30)17-35-26-10-5-8-15-33-26/h11-12,16,18,26H,3-10,13-15,17,28H2,1-2H3