methyl 4-[4-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]phenoxy]butanoate

Systemtic Name: methyl 4-[4-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]phenoxy]butanoate Openeye Name: methyl 4-[4-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]phenoxy]butanoate CAS Name: 4-[4-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]phenoxy]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrochromen-4-yl]phenoxy]butanoate Traditional Name: 4-[4-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]phenoxy]butyric acid methyl ester Formula: C27H28O6 MolecularWeight: 448.50762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C1C3=CC=C(C=C3)OCCCC(=O)OC)C=CC(=C2)O)C4=CC=C(C=C4)O

Isomeric SMILES

CC1(COC2=C(C1C3=CC=C(C=C3)OCCCC(=O)OC)C=CC(=C2)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C27H28O6/c1-27(19-7-9-20(28)10-8-19)17-33-24-16-21(29)11-14-23(24)26(27)18-5-12-22(13-6-18)32-15-3-4-25(30)31-2/h5-14,16,26,28-29H,3-4,15,17H2,1-2H3