[[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-naphthalen-1-yl-methyl] 2-phenylmethoxyethanoate

Systemtic Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-naphthalen-1-yl-methyl] 2-phenylmethoxyethanoate Openeye Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-(1-naphthyl)methyl] 2-benzyloxyacetate CAS Name: 2-phenylmethoxyacetic acid [[(1E)-1-cyclodec-1-en-3,9-diynyl]-(1-naphthalenyl)methyl] ester IUPAC Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-naphthalen-1-ylmethyl] 2-phenylmethoxyacetate Traditional Name: 2-benzoxyacetic acid [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-(1-naphthyl)methyl] ester Formula: C30H26O3 MolecularWeight: 434.52564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC#CC(=CC#CC1)C(C2=CC=CC3=CC=CC=C32)OC(=O)COCC4=CC=CC=C4

Isomeric SMILES

C1CCC#C/C(=C\C#CC1)/C(C2=CC=CC3=CC=CC=C32)OC(=O)COCC4=CC=CC=C4

InChI

InChI=1S/C30H26O3/c31-29(23-32-22-24-14-7-6-8-15-24)33-30(26-17-9-4-2-1-3-5-10-18-26)28-21-13-19-25-16-11-12-20-27(25)28/h6-8,11-16,18-21,30H,1-4,22-23H2/b26-18+