3-(3-oxidanylspiro[3.5]nonan-3-yl)prop-2-ynyl benzoate

Systemtic Name: 3-(3-oxidanylspiro[3.5]nonan-3-yl)prop-2-ynyl benzoate Openeye Name: 3-(3-hydroxyspiro[3.5]nonan-3-yl)prop-2-ynyl benzoate CAS Name: benzoic acid 3-(3-hydroxy-3-spiro[3.5]nonanyl)prop-2-ynyl ester IUPAC Name: 3-(3-hydroxyspiro[3.5]nonan-3-yl)prop-2-ynyl benzoate Traditional Name: benzoic acid 3-(3-hydroxyspiro[3.5]nonan-3-yl)prop-2-ynyl ester Formula: C19H22O3 MolecularWeight: 298.37618

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CCC2(C#CCOC(=O)C3=CC=CC=C3)O

Isomeric SMILES

C1CCC2(CC1)CCC2(C#CCOC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C19H22O3/c20-17(16-8-3-1-4-9-16)22-15-7-12-19(21)14-13-18(19)10-5-2-6-11-18/h1,3-4,8-9,21H,2,5-6,10-11,13-15H2