ethyl (3S)-1-[2-[3-(2-fluoranylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-yl]oxyethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-[3-(2-fluoranylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-yl]oxyethanoyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-[3-(2-fluorophenoxy)-2-methyl-4-oxo-chromen-7-yl]oxyacetyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-[[3-(2-fluorophenoxy)-2-methyl-4-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-[3-(2-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxyacetyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-[3-(2-fluorophenoxy)-4-keto-2-methyl-chromen-7-yl]oxyacetyl]nipecotic acid ethyl ester Formula: C26H26FNO7 MolecularWeight: 483.485543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C)OC4=CC=CC=C4F

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C)OC4=CC=CC=C4F

InChI

InChI=1S/C26H26FNO7/c1-3-32-26(31)17-7-6-12-28(14-17)23(29)15-33-18-10-11-19-22(13-18)34-16(2)25(24(19)30)35-21-9-5-4-8-20(21)27/h4-5,8-11,13,17H,3,6-7,12,14-15H2,1-2H3/t17-/m0/s1