3-[(3,5-dimethyl-2-oxidanyl-phenyl)methyl]-2-oxidanyl-5,6,7,8-tetrahydrochromen-4-one

Systemtic Name: 3-[(3,5-dimethyl-2-oxidanyl-phenyl)methyl]-2-oxidanyl-5,6,7,8-tetrahydrochromen-4-one Openeye Name: 2-hydroxy-3-[(2-hydroxy-3,5-dimethyl-phenyl)methyl]-5,6,7,8-tetrahydrochromen-4-one CAS Name: 2-hydroxy-3-[(2-hydroxy-3,5-dimethylphenyl)methyl]-5,6,7,8-tetrahydro-1-benzopyran-4-one IUPAC Name: 2-hydroxy-3-[(2-hydroxy-3,5-dimethylphenyl)methyl]-5,6,7,8-tetrahydrochromen-4-one Traditional Name: 2-hydroxy-3-(2-hydroxy-3,5-dimethyl-benzyl)-5,6,7,8-tetrahydrochromen-4-one Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CC2=C(OC3=C(C2=O)CCCC3)O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)CC2=C(OC3=C(C2=O)CCCC3)O)O)C

InChI

InChI=1S/C18H20O4/c1-10-7-11(2)16(19)12(8-10)9-14-17(20)13-5-3-4-6-15(13)22-18(14)21/h7-8,19,21H,3-6,9H2,1-2H3