1-phenylprop-2-ynyl 3-oxidanylidene-2-(phenylmethyl)butanoate

Systemtic Name: 1-phenylprop-2-ynyl 3-oxidanylidene-2-(phenylmethyl)butanoate Openeye Name: 1-phenylprop-2-ynyl 2-benzyl-3-oxo-butanoate CAS Name: 3-oxo-2-(phenylmethyl)butanoic acid 1-phenylprop-2-ynyl ester IUPAC Name: 1-phenylprop-2-ynyl 2-benzyl-3-oxobutanoate Traditional Name: 2-benzyl-3-keto-butyric acid 1-phenylprop-2-ynyl ester Formula: C20H18O3 MolecularWeight: 306.35512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)C(=O)OC(C#C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C(CC1=CC=CC=C1)C(=O)OC(C#C)C2=CC=CC=C2

InChI

InChI=1S/C20H18O3/c1-3-19(17-12-8-5-9-13-17)23-20(22)18(15(2)21)14-16-10-6-4-7-11-16/h1,4-13,18-19H,14H2,2H3