diethyl 2,2-bis(3-naphthalen-1-ylprop-2-ynyl)propanedioate

Systemtic Name: diethyl 2,2-bis(3-naphthalen-1-ylprop-2-ynyl)propanedioate Openeye Name: diethyl 2,2-bis[3-(1-naphthyl)prop-2-ynyl]propanedioate CAS Name: 2,2-bis[3-(1-naphthalenyl)prop-2-ynyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2,2-bis(3-naphthalen-1-ylprop-2-ynyl)propanedioate Traditional Name: 2,2-bis[3-(1-naphthyl)prop-2-ynyl]malonic acid diethyl ester Formula: C33H28O4 MolecularWeight: 488.57302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC#CC1=CC=CC2=CC=CC=C21)(CC#CC3=CC=CC4=CC=CC=C43)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC#CC1=CC=CC2=CC=CC=C21)(CC#CC3=CC=CC4=CC=CC=C43)C(=O)OCC

InChI

InChI=1S/C33H28O4/c1-3-36-31(34)33(32(35)37-4-2,23-11-19-27-17-9-15-25-13-5-7-21-29(25)27)24-12-20-28-18-10-16-26-14-6-8-22-30(26)28/h5-10,13-18,21-22H,3-4,23-24H2,1-2H3