7-octadecanoyl-10-(10-oxidanylidene-4aH-anthracen-9-yl)-8aH-anthracen-9-one

Systemtic Name: 7-octadecanoyl-10-(10-oxidanylidene-4aH-anthracen-9-yl)-8aH-anthracen-9-one Openeye Name: 7-octadecanoyl-10-(10-oxo-4aH-anthracen-9-yl)-8aH-anthracen-9-one CAS Name: 10-(10-oxo-4aH-anthracen-9-yl)-7-(1-oxooctadecyl)-8aH-anthracen-9-one IUPAC Name: 7-octadecanoyl-10-(10-oxo-4aH-anthracen-9-yl)-8aH-anthracen-9-one Traditional Name: 10-(10-keto-4aH-anthracen-9-yl)-7-stearoyl-8aH-anthracen-9-one Formula: C46H52O3 MolecularWeight: 652.90328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=CC2C(=C(C3=CC=CC=C3C2=O)C4=C5C=CC=CC5C(=O)C6=CC=CC=C64)C=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=CC2C(=C(C3=CC=CC=C3C2=O)C4=C5C=CC=CC5C(=O)C6=CC=CC=C64)C=C1

InChI

InChI=1S/C46H52O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-29-42(47)33-30-31-37-41(32-33)46(49)40-28-22-19-25-36(40)44(37)43-34-23-17-20-26-38(34)45(48)39-27-21-18-24-35(39)43/h17-28,30-32,38,41H,2-16,29H2,1H3