3-(4-chloranyl-3,5-dimethyl-phenoxy)-7-[3-(2-methylpiperidin-1-yl)-2-oxidanyl-propoxy]chromen-4-one

Systemtic Name: 3-(4-chloranyl-3,5-dimethyl-phenoxy)-7-[3-(2-methylpiperidin-1-yl)-2-oxidanyl-propoxy]chromen-4-one Openeye Name: 3-(4-chloro-3,5-dimethyl-phenoxy)-7-[2-hydroxy-3-(2-methyl-1-piperidyl)propoxy]chromen-4-one CAS Name: 3-(4-chloro-3,5-dimethylphenoxy)-7-[2-hydroxy-3-(2-methyl-1-piperidinyl)propoxy]-1-benzopyran-4-one IUPAC Name: 3-(4-chloro-3,5-dimethylphenoxy)-7-[2-hydroxy-3-(2-methylpiperidin-1-yl)propoxy]chromen-4-one Traditional Name: 3-(4-chloro-3,5-dimethyl-phenoxy)-7-[2-hydroxy-3-(2-methylpiperidino)propoxy]chromone Formula: C26H30ClNO5 MolecularWeight: 471.9731

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC(COC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC(=C(C(=C4)C)Cl)C)O

Isomeric SMILES

CC1CCCCN1CC(COC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC(=C(C(=C4)C)Cl)C)O

InChI

InChI=1S/C26H30ClNO5/c1-16-10-21(11-17(2)25(16)27)33-24-15-32-23-12-20(7-8-22(23)26(24)30)31-14-19(29)13-28-9-5-4-6-18(28)3/h7-8,10-12,15,18-19,29H,4-6,9,13-14H2,1-3H3