[1-(cyclohexen-1-yl)-4-methyl-pent-1-yn-3-yl] benzoate

Systemtic Name: [1-(cyclohexen-1-yl)-4-methyl-pent-1-yn-3-yl] benzoate Openeye Name: [3-(cyclohexen-1-yl)-1-isopropyl-prop-2-ynyl] benzoate CAS Name: benzoic acid [1-(1-cyclohexenyl)-4-methylpent-1-yn-3-yl] ester IUPAC Name: [1-(cyclohexen-1-yl)-4-methylpent-1-yn-3-yl] benzoate Traditional Name: benzoic acid [3-(cyclohexen-1-yl)-1-isopropyl-prop-2-ynyl] ester Formula: C19H22O2 MolecularWeight: 282.37678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#CC1=CCCCC1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(C#CC1=CCCCC1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22O2/c1-15(2)18(14-13-16-9-5-3-6-10-16)21-19(20)17-11-7-4-8-12-17/h4,7-9,11-12,15,18H,3,5-6,10H2,1-2H3