ethyl 2-ethanoyl-2-(3-phenylprop-2-ynyl)pent-4-enoate

Systemtic Name: ethyl 2-ethanoyl-2-(3-phenylprop-2-ynyl)pent-4-enoate Openeye Name: ethyl 2-acetyl-2-(3-phenylprop-2-ynyl)pent-4-enoate CAS Name: 2-acetyl-2-(3-phenylprop-2-ynyl)-4-pentenoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-2-(3-phenylprop-2-ynyl)pent-4-enoate Traditional Name: 2-acetyl-2-(3-phenylprop-2-ynyl)pent-4-enoic acid ethyl ester Formula: C18H20O3 MolecularWeight: 284.3496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C)(CC#CC1=CC=CC=C1)C(=O)C

Isomeric SMILES

CCOC(=O)C(CC=C)(CC#CC1=CC=CC=C1)C(=O)C

InChI

InChI=1S/C18H20O3/c1-4-13-18(15(3)19,17(20)21-5-2)14-9-12-16-10-7-6-8-11-16/h4,6-8,10-11H,1,5,13-14H2,2-3H3