[(6S)-6-methyl-7-(oxan-2-yloxy)hept-1-yn-3-yl] benzoate

Systemtic Name: [(6S)-6-methyl-7-(oxan-2-yloxy)hept-1-yn-3-yl] benzoate Openeye Name: [(4S)-1-ethynyl-4-methyl-5-tetrahydropyran-2-yloxy-pentyl] benzoate CAS Name: benzoic acid [(6S)-6-methyl-7-(2-oxanyloxy)hept-1-yn-3-yl] ester IUPAC Name: [(6S)-6-methyl-7-(oxan-2-yloxy)hept-1-yn-3-yl] benzoate Traditional Name: benzoic acid 1-[(3S)-3-methyl-4-tetrahydropyran-2-yloxy-butyl]prop-2-ynyl ester Formula: C20H26O4 MolecularWeight: 330.41804

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C#C)OC(=O)C1=CC=CC=C1)COC2CCCCO2

Isomeric SMILES

C[C@@H](CCC(C#C)OC(=O)C1=CC=CC=C1)COC2CCCCO2

InChI

InChI=1S/C20H26O4/c1-3-18(24-20(21)17-9-5-4-6-10-17)13-12-16(2)15-23-19-11-7-8-14-22-19/h1,4-6,9-10,16,18-19H,7-8,11-15H2,2H3/t16-,18?,19?/m0/s1