[6-ethyl-3-(4-fluoranylphenoxy)-2-methyl-4-oxidanylidene-8-(piperidin-1-ylmethyl)chromen-7-yl] ethanoate

Systemtic Name: [6-ethyl-3-(4-fluoranylphenoxy)-2-methyl-4-oxidanylidene-8-(piperidin-1-ylmethyl)chromen-7-yl] ethanoate Openeye Name: [6-ethyl-3-(4-fluorophenoxy)-2-methyl-4-oxo-8-(1-piperidylmethyl)chromen-7-yl] acetate CAS Name: acetic acid [6-ethyl-3-(4-fluorophenoxy)-2-methyl-4-oxo-8-(1-piperidinylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-3-(4-fluorophenoxy)-2-methyl-4-oxo-8-(piperidin-1-ylmethyl)chromen-7-yl] acetate Traditional Name: acetic acid [6-ethyl-3-(4-fluorophenoxy)-4-keto-2-methyl-8-(piperidinomethyl)chromen-7-yl] ester Formula: C26H28FNO5 MolecularWeight: 453.502623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C)OC3=CC=C(C=C3)F)CN4CCCCC4)OC(=O)C

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C)OC3=CC=C(C=C3)F)CN4CCCCC4)OC(=O)C

InChI

InChI=1S/C26H28FNO5/c1-4-18-14-21-23(30)24(33-20-10-8-19(27)9-11-20)16(2)31-26(21)22(25(18)32-17(3)29)15-28-12-6-5-7-13-28/h8-11,14H,4-7,12-13,15H2,1-3H3