4-(diethylamino)but-2-ynyl 2-[3-(acetyloxymethyl)phenyl]-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: 4-(diethylamino)but-2-ynyl 2-[3-(acetyloxymethyl)phenyl]-2-oxidanyl-2-phenyl-ethanoate Openeye Name: 4-(diethylamino)but-2-ynyl 2-[3-(acetoxymethyl)phenyl]-2-hydroxy-2-phenyl-acetate CAS Name: 2-[3-(acetyloxymethyl)phenyl]-2-hydroxy-2-phenylacetic acid 4-(diethylamino)but-2-ynyl ester IUPAC Name: 4-(diethylamino)but-2-ynyl 2-[3-(acetyloxymethyl)phenyl]-2-hydroxy-2-phenylacetate Traditional Name: 2-[3-(acetoxymethyl)phenyl]-2-hydroxy-2-phenyl-acetic acid 4-(diethylamino)but-2-ynyl ester Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC(=C2)COC(=O)C)O

Isomeric SMILES

CCN(CC)CC#CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC(=C2)COC(=O)C)O

InChI

InChI=1S/C25H29NO5/c1-4-26(5-2)16-9-10-17-30-24(28)25(29,22-13-7-6-8-14-22)23-15-11-12-21(18-23)19-31-20(3)27/h6-8,11-15,18,29H,4-5,16-17,19H2,1-3H3