(2S)-3-(4-hydroxyphenyl)-1-(7-methoxy-2,2-dimethyl-chromen-6-yl)-2-oxidanyl-propan-1-one

Systemtic Name: (2S)-3-(4-hydroxyphenyl)-1-(7-methoxy-2,2-dimethyl-chromen-6-yl)-2-oxidanyl-propan-1-one Openeye Name: (2S)-2-hydroxy-3-(4-hydroxyphenyl)-1-(7-methoxy-2,2-dimethyl-chromen-6-yl)propan-1-one CAS Name: (2S)-2-hydroxy-3-(4-hydroxyphenyl)-1-(7-methoxy-2,2-dimethyl-1-benzopyran-6-yl)-1-propanone IUPAC Name: (2S)-2-hydroxy-3-(4-hydroxyphenyl)-1-(7-methoxy-2,2-dimethylchromen-6-yl)propan-1-one Traditional Name: (2S)-2-hydroxy-3-(4-hydroxyphenyl)-1-(7-methoxy-2,2-dimethyl-chromen-6-yl)propan-1-one Formula: C21H22O5 MolecularWeight: 354.39638

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=CC(=C(C=C2O1)OC)C(=O)C(CC3=CC=C(C=C3)O)O)C

Isomeric SMILES

CC1(C=CC2=CC(=C(C=C2O1)OC)C(=O)[C@H](CC3=CC=C(C=C3)O)O)C

InChI

InChI=1S/C21H22O5/c1-21(2)9-8-14-11-16(19(25-3)12-18(14)26-21)20(24)17(23)10-13-4-6-15(22)7-5-13/h4-9,11-12,17,22-23H,10H2,1-3H3/t17-/m0/s1