5,7-diphenyl-1-(3,3,5,5-tetramethylcyclohexen-1-yl)hept-2-yne-1,6-dione

Systemtic Name: 5,7-diphenyl-1-(3,3,5,5-tetramethylcyclohexen-1-yl)hept-2-yne-1,6-dione Openeye Name: 5,7-diphenyl-1-(3,3,5,5-tetramethylcyclohexen-1-yl)hept-2-yne-1,6-dione CAS Name: 5,7-diphenyl-1-(3,3,5,5-tetramethyl-1-cyclohexenyl)-2-heptyne-1,6-dione IUPAC Name: 5,7-diphenyl-1-(3,3,5,5-tetramethylcyclohexen-1-yl)hept-2-yne-1,6-dione Traditional Name: 5,7-diphenyl-1-(3,3,5,5-tetramethylcyclohexen-1-yl)hept-2-yne-1,6-dione Formula: C29H32O2 MolecularWeight: 412.56318

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(C1)(C)C)C(=O)C#CCC(C2=CC=CC=C2)C(=O)CC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(=CC(C1)(C)C)C(=O)C#CCC(C2=CC=CC=C2)C(=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C29H32O2/c1-28(2)19-24(20-29(3,4)21-28)26(30)17-11-16-25(23-14-9-6-10-15-23)27(31)18-22-12-7-5-8-13-22/h5-10,12-15,19,25H,16,18,20-21H2,1-4H3