4-(dimethylamino)-1-[6-[4-(dimethylamino)butanoyl]-9H-xanthen-3-yl]butan-1-one

Systemtic Name: 4-(dimethylamino)-1-[6-[4-(dimethylamino)butanoyl]-9H-xanthen-3-yl]butan-1-one Openeye Name: 4-(dimethylamino)-1-[6-[4-(dimethylamino)butanoyl]-9H-xanthen-3-yl]butan-1-one CAS Name: 4-(dimethylamino)-1-[6-[4-(dimethylamino)-1-oxobutyl]-9H-xanthen-3-yl]-1-butanone IUPAC Name: 4-(dimethylamino)-1-[6-[4-(dimethylamino)butanoyl]-9H-xanthen-3-yl]butan-1-one Traditional Name: 4-(dimethylamino)-1-[6-[4-(dimethylamino)butanoyl]-9H-xanthen-3-yl]butan-1-one Formula: C25H32N2O3 MolecularWeight: 408.53318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC(=O)C1=CC2=C(CC3=C(O2)C=C(C=C3)C(=O)CCCN(C)C)C=C1

Isomeric SMILES

CN(C)CCCC(=O)C1=CC2=C(CC3=C(O2)C=C(C=C3)C(=O)CCCN(C)C)C=C1

InChI

InChI=1S/C25H32N2O3/c1-26(2)13-5-7-22(28)18-9-11-20-15-21-12-10-19(17-25(21)30-24(20)16-18)23(29)8-6-14-27(3)4/h9-12,16-17H,5-8,13-15H2,1-4H3