3-[4-[6,6-bis(bromanyl)hex-3-ynylsulfonyl]phenyl]-5-phenyl-1-propoxy-pyridin-4-one

Systemtic Name: 3-[4-[6,6-bis(bromanyl)hex-3-ynylsulfonyl]phenyl]-5-phenyl-1-propoxy-pyridin-4-one Openeye Name: 3-[4-(6,6-dibromohex-3-ynylsulfonyl)phenyl]-5-phenyl-1-propoxy-pyridin-4-one CAS Name: 3-[4-(6,6-dibromohex-3-ynylsulfonyl)phenyl]-5-phenyl-1-propoxy-4-pyridinone IUPAC Name: 3-[4-(6,6-dibromohex-3-ynylsulfonyl)phenyl]-5-phenyl-1-propoxypyridin-4-one Traditional Name: 3-[4-(6,6-dibromohex-3-ynylsulfonyl)phenyl]-5-phenyl-1-propoxy-4-pyridone Formula: C26H25Br2NO4S MolecularWeight: 607.354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCON1C=C(C(=O)C(=C1)C2=CC=C(C=C2)S(=O)(=O)CCC#CCC(Br)Br)C3=CC=CC=C3

Isomeric SMILES

CCCON1C=C(C(=O)C(=C1)C2=CC=C(C=C2)S(=O)(=O)CCC#CCC(Br)Br)C3=CC=CC=C3

InChI

InChI=1S/C26H25Br2NO4S/c1-2-16-33-29-18-23(20-9-5-3-6-10-20)26(30)24(19-29)21-12-14-22(15-13-21)34(31,32)17-8-4-7-11-25(27)28/h3,5-6,9-10,12-15,18-19,25H,2,8,11,16-17H2,1H3