[1-(cyclohexen-1-yl)-3-methyl-5-phenyl-pent-1-yn-3-yl] benzoate

Systemtic Name: [1-(cyclohexen-1-yl)-3-methyl-5-phenyl-pent-1-yn-3-yl] benzoate Openeye Name: [3-(cyclohexen-1-yl)-1-methyl-1-phenethyl-prop-2-ynyl] benzoate CAS Name: benzoic acid [1-(1-cyclohexenyl)-3-methyl-5-phenylpent-1-yn-3-yl] ester IUPAC Name: [1-(cyclohexen-1-yl)-3-methyl-5-phenylpent-1-yn-3-yl] benzoate Traditional Name: benzoic acid [3-(cyclohexen-1-yl)-1-methyl-1-phenethyl-prop-2-ynyl] ester Formula: C25H26O2 MolecularWeight: 358.47274

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)(C#CC2=CCCCC2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CCC1=CC=CC=C1)(C#CC2=CCCCC2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H26O2/c1-25(19-17-21-11-5-2-6-12-21,20-18-22-13-7-3-8-14-22)27-24(26)23-15-9-4-10-16-23/h2,4-6,9-13,15-16H,3,7-8,14,17,19H2,1H3