[2,2-dimethyl-3-(3-oxidanylpropyl)-7-(5-phenylpentan-2-yloxy)-3,4-dihydrochromen-5-yl] ethanoate

Systemtic Name: [2,2-dimethyl-3-(3-oxidanylpropyl)-7-(5-phenylpentan-2-yloxy)-3,4-dihydrochromen-5-yl] ethanoate Openeye Name: [3-(3-hydroxypropyl)-2,2-dimethyl-7-(1-methyl-4-phenyl-butoxy)chroman-5-yl] acetate CAS Name: acetic acid [3-(3-hydroxypropyl)-2,2-dimethyl-7-(5-phenylpentan-2-yloxy)-3,4-dihydro-2H-1-benzopyran-5-yl] ester IUPAC Name: [3-(3-hydroxypropyl)-2,2-dimethyl-7-(5-phenylpentan-2-yloxy)-3,4-dihydrochromen-5-yl] acetate Traditional Name: acetic acid [3-(3-hydroxypropyl)-2,2-dimethyl-7-(1-methyl-4-phenyl-butoxy)chroman-5-yl] ester Formula: C27H36O5 MolecularWeight: 440.57174

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)OC2=CC(=C3CC(C(OC3=C2)(C)C)CCCO)OC(=O)C

Isomeric SMILES

CC(CCCC1=CC=CC=C1)OC2=CC(=C3CC(C(OC3=C2)(C)C)CCCO)OC(=O)C

InChI

InChI=1S/C27H36O5/c1-19(10-8-13-21-11-6-5-7-12-21)30-23-17-25(31-20(2)29)24-16-22(14-9-15-28)27(3,4)32-26(24)18-23/h5-7,11-12,17-19,22,28H,8-10,13-16H2,1-4H3