[6-(1,3-dioxolan-2-yl)-4-(phenylmethyl)hex-1-yn-3-yl] benzoate

Systemtic Name: [6-(1,3-dioxolan-2-yl)-4-(phenylmethyl)hex-1-yn-3-yl] benzoate Openeye Name: [2-benzyl-4-(1,3-dioxolan-2-yl)-1-ethynyl-butyl] benzoate CAS Name: benzoic acid [6-(1,3-dioxolan-2-yl)-4-(phenylmethyl)hex-1-yn-3-yl] ester IUPAC Name: [4-benzyl-6-(1,3-dioxolan-2-yl)hex-1-yn-3-yl] benzoate Traditional Name: benzoic acid 1-[1-benzyl-3-(1,3-dioxolan-2-yl)propyl]prop-2-ynyl ester Formula: C23H24O4 MolecularWeight: 364.43426

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(C(CCC1OCCO1)CC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C#CC(C(CCC1OCCO1)CC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H24O4/c1-2-21(27-23(24)19-11-7-4-8-12-19)20(13-14-22-25-15-16-26-22)17-18-9-5-3-6-10-18/h1,3-12,20-22H,13-17H2