[5-methyl-2-[(2S)-2,4,4,7-tetramethyl-3H-chromen-2-yl]phenyl] benzoate

Systemtic Name: [5-methyl-2-[(2S)-2,4,4,7-tetramethyl-3H-chromen-2-yl]phenyl] benzoate Openeye Name: [5-methyl-2-[(2S)-2,4,4,7-tetramethylchroman-2-yl]phenyl] benzoate CAS Name: benzoic acid [5-methyl-2-[(2S)-2,4,4,7-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]phenyl] ester IUPAC Name: [5-methyl-2-[(2S)-2,4,4,7-tetramethyl-3H-chromen-2-yl]phenyl] benzoate Traditional Name: benzoic acid [5-methyl-2-[(2S)-2,4,4,7-tetramethylchroman-2-yl]phenyl] ester Formula: C27H28O3 MolecularWeight: 400.50942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(CC(O2)(C)C3=C(C=C(C=C3)C)OC(=O)C4=CC=CC=C4)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(C[C@@](O2)(C)C3=C(C=C(C=C3)C)OC(=O)C4=CC=CC=C4)(C)C

InChI

InChI=1S/C27H28O3/c1-18-12-14-22(23(15-18)29-25(28)20-9-7-6-8-10-20)27(5)17-26(3,4)21-13-11-19(2)16-24(21)30-27/h6-16H,17H2,1-5H3/t27-/m0/s1