diethyl 2-cyclohex-2-en-1-yl-2-[3-(2-methanoylphenyl)prop-2-ynyl]propanedioate

Systemtic Name: diethyl 2-cyclohex-2-en-1-yl-2-[3-(2-methanoylphenyl)prop-2-ynyl]propanedioate Openeye Name: diethyl 2-cyclohex-2-en-1-yl-2-[3-(2-formylphenyl)prop-2-ynyl]propanedioate CAS Name: 2-(1-cyclohex-2-enyl)-2-[3-(2-formylphenyl)prop-2-ynyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-cyclohex-2-en-1-yl-2-[3-(2-formylphenyl)prop-2-ynyl]propanedioate Traditional Name: 2-cyclohex-2-en-1-yl-2-[3-(2-formylphenyl)prop-2-ynyl]malonic acid diethyl ester Formula: C23H26O5 MolecularWeight: 382.44954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC#CC1=CC=CC=C1C=O)(C2CCCC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC#CC1=CC=CC=C1C=O)(C2CCCC=C2)C(=O)OCC

InChI

InChI=1S/C23H26O5/c1-3-27-21(25)23(22(26)28-4-2,20-14-6-5-7-15-20)16-10-13-18-11-8-9-12-19(18)17-24/h6,8-9,11-12,14,17,20H,3-5,7,15-16H2,1-2H3