(5-oxidanyl-2-phenyl-3,4-dihydro-2H-chromen-7-yl) 2,2-dimethylpropanoate hydrochloride

Systemtic Name: (5-oxidanyl-2-phenyl-3,4-dihydro-2H-chromen-7-yl) 2,2-dimethylpropanoate hydrochloride Openeye Name: (5-hydroxy-2-phenyl-chroman-7-yl) 2,2-dimethylpropanoate hydrochloride CAS Name: 2,2-dimethylpropanoic acid (5-hydroxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-7-yl) ester hydrochloride IUPAC Name: (5-hydroxy-2-phenyl-3,4-dihydro-2H-chromen-7-yl) 2,2-dimethylpropanoate hydrochloride Traditional Name: 2,2-dimethylpropionic acid (5-hydroxy-2-phenyl-chroman-7-yl) ester hydrochloride Formula: C20H23ClO4 MolecularWeight: 362.84722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC(=C2CCC(OC2=C1)C3=CC=CC=C3)O.Cl

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC(=C2CCC(OC2=C1)C3=CC=CC=C3)O.Cl

InChI

InChI=1S/C20H22O4.ClH/c1-20(2,3)19(22)23-14-11-16(21)15-9-10-17(24-18(15)12-14)13-7-5-4-6-8-13;/h4-8,11-12,17,21H,9-10H2,1-3H3;1H