3-[3-(bromomethyl)-1-phenyl-nonadecan-6-yl]-1H-pyridine-2,4-dione

Systemtic Name: 3-[3-(bromomethyl)-1-phenyl-nonadecan-6-yl]-1H-pyridine-2,4-dione Openeye Name: 3-[1-[3-(bromomethyl)-5-phenyl-pentyl]tetradecyl]-1H-pyridine-2,4-dione CAS Name: 3-[3-(bromomethyl)-1-phenylnonadecan-6-yl]-1H-pyridine-2,4-dione IUPAC Name: 3-[3-(bromomethyl)-1-phenylnonadecan-6-yl]-1H-pyridine-2,4-dione Traditional Name: 3-[1-[3-(bromomethyl)-5-phenyl-pentyl]tetradecyl]-1H-pyridine-2,4-quinone Formula: C31H48BrNO2 MolecularWeight: 546.62232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCC(CCC1=CC=CC=C1)CBr)C2C(=O)C=CNC2=O

Isomeric SMILES

CCCCCCCCCCCCCC(CCC(CCC1=CC=CC=C1)CBr)C2C(=O)C=CNC2=O

InChI

InChI=1S/C31H48BrNO2/c1-2-3-4-5-6-7-8-9-10-11-15-18-28(30-29(34)23-24-33-31(30)35)22-21-27(25-32)20-19-26-16-13-12-14-17-26/h12-14,16-17,23-24,27-28,30H,2-11,15,18-22,25H2,1H3,(H,33,35)