5,6-bis(hex-1-ynyl)-1-methyl-3-(phenylcarbonyl)pyrimidine-2,4-dione

Systemtic Name: 5,6-bis(hex-1-ynyl)-1-methyl-3-(phenylcarbonyl)pyrimidine-2,4-dione Openeye Name: 3-benzoyl-5,6-bis(hex-1-ynyl)-1-methyl-pyrimidine-2,4-dione CAS Name: 3-benzoyl-5,6-bis(hex-1-ynyl)-1-methylpyrimidine-2,4-dione IUPAC Name: 3-benzoyl-5,6-bis(hex-1-ynyl)-1-methylpyrimidine-2,4-dione Traditional Name: 3-benzoyl-5,6-bis(hex-1-ynyl)-1-methyl-pyrimidine-2,4-quinone Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(N(C(=O)N(C1=O)C(=O)C2=CC=CC=C2)C)C#CCCCC

Isomeric SMILES

CCCCC#CC1=C(N(C(=O)N(C1=O)C(=O)C2=CC=CC=C2)C)C#CCCCC

InChI

InChI=1S/C24H26N2O3/c1-4-6-8-13-17-20-21(18-14-9-7-5-2)25(3)24(29)26(23(20)28)22(27)19-15-11-10-12-16-19/h10-12,15-16H,4-9H2,1-3H3