3-(4,4-dimethyl-2,3-dihydrochromen-8-yl)prop-1-ynyl 4-methyl-2,3-bis(oxidanyl)benzoate

Systemtic Name: 3-(4,4-dimethyl-2,3-dihydrochromen-8-yl)prop-1-ynyl 4-methyl-2,3-bis(oxidanyl)benzoate Openeye Name: 3-(4,4-dimethylchroman-8-yl)prop-1-ynyl 2,3-dihydroxy-4-methyl-benzoate CAS Name: 2,3-dihydroxy-4-methylbenzoic acid 3-(4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-8-yl)prop-1-ynyl ester IUPAC Name: 3-(4,4-dimethyl-2,3-dihydrochromen-8-yl)prop-1-ynyl 2,3-dihydroxy-4-methylbenzoate Traditional Name: 2,3-dihydroxy-4-methyl-benzoic acid 3-(4,4-dimethylchroman-8-yl)prop-1-ynyl ester Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)OC#CCC2=CC=CC3=C2OCCC3(C)C)O)O

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)OC#CCC2=CC=CC3=C2OCCC3(C)C)O)O

InChI

InChI=1S/C22H22O5/c1-14-9-10-16(19(24)18(14)23)21(25)27-12-5-7-15-6-4-8-17-20(15)26-13-11-22(17,2)3/h4,6,8-10,23-24H,7,11,13H2,1-3H3