[5-(5-indol-1-ylpentoxy)-4-oxidanylidene-pyran-2-yl]methyl 2-phenylethanoate

Systemtic Name: [5-(5-indol-1-ylpentoxy)-4-oxidanylidene-pyran-2-yl]methyl 2-phenylethanoate Openeye Name: [5-(5-indol-1-ylpentoxy)-4-oxo-pyran-2-yl]methyl 2-phenylacetate CAS Name: 2-phenylacetic acid [5-[5-(1-indolyl)pentoxy]-4-oxo-2-pyranyl]methyl ester IUPAC Name: [5-(5-indol-1-ylpentoxy)-4-oxopyran-2-yl]methyl 2-phenylacetate Traditional Name: 2-phenylacetic acid [5-(5-indol-1-ylpentoxy)-4-keto-pyran-2-yl]methyl ester Formula: C27H27NO5 MolecularWeight: 445.50698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)OCC2=CC(=O)C(=CO2)OCCCCCN3C=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)OCC2=CC(=O)C(=CO2)OCCCCCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C27H27NO5/c29-25-18-23(19-33-27(30)17-21-9-3-1-4-10-21)32-20-26(25)31-16-8-2-7-14-28-15-13-22-11-5-6-12-24(22)28/h1,3-6,9-13,15,18,20H,2,7-8,14,16-17,19H2