ethyl 1-[(2S)-3-[3-(4-chloranylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-yl]oxy-2-oxidanyl-propyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2S)-3-[3-(4-chloranylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-yl]oxy-2-oxidanyl-propyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(2S)-3-[3-(4-chlorophenoxy)-2-methyl-4-oxo-chromen-7-yl]oxy-2-hydroxy-propyl]piperidine-4-carboxylate CAS Name: 1-[(2S)-3-[[3-(4-chlorophenoxy)-2-methyl-4-oxo-1-benzopyran-7-yl]oxy]-2-hydroxypropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2S)-3-[3-(4-chlorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-2-hydroxypropyl]piperidine-4-carboxylate Traditional Name: 1-[(2S)-3-[3-(4-chlorophenoxy)-4-keto-2-methyl-chromen-7-yl]oxy-2-hydroxy-propyl]isonipecotic acid ethyl ester Formula: C27H30ClNO7 MolecularWeight: 515.9826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(COC2=CC3=C(C=C2)C(=O)C(=C(O3)C)OC4=CC=C(C=C4)Cl)O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C[C@@H](COC2=CC3=C(C=C2)C(=O)C(=C(O3)C)OC4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C27H30ClNO7/c1-3-33-27(32)18-10-12-29(13-11-18)15-20(30)16-34-22-8-9-23-24(14-22)35-17(2)26(25(23)31)36-21-6-4-19(28)5-7-21/h4-9,14,18,20,30H,3,10-13,15-16H2,1-2H3/t20-/m0/s1