bis[3-(diethylamino)propyl] fluoranthene-2,9-dicarboxylate hydrochloride

Systemtic Name: bis[3-(diethylamino)propyl] fluoranthene-2,9-dicarboxylate hydrochloride Openeye Name: bis[3-(diethylamino)propyl] fluoranthene-2,9-dicarboxylate hydrochloride CAS Name: fluoranthene-2,9-dicarboxylic acid bis[3-(diethylamino)propyl] ester hydrochloride IUPAC Name: bis[3-(diethylamino)propyl] fluoranthene-2,9-dicarboxylate hydrochloride Traditional Name: fluoranthene-2,9-dicarboxylic acid bis[3-(diethylamino)propyl] ester hydrochloride Formula: C32H41ClN2O4 MolecularWeight: 553.13194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC(=O)C1=CC2=C(C=C1)C3=CC=CC4=CC(=CC2=C43)C(=O)OCCCN(CC)CC.Cl

Isomeric SMILES

CCN(CC)CCCOC(=O)C1=CC2=C(C=C1)C3=CC=CC4=CC(=CC2=C43)C(=O)OCCCN(CC)CC.Cl

InChI

InChI=1S/C32H40N2O4.ClH/c1-5-33(6-2)16-10-18-37-31(35)24-14-15-26-27-13-9-12-23-20-25(22-29(30(23)27)28(26)21-24)32(36)38-19-11-17-34(7-3)8-4;/h9,12-15,20-22H,5-8,10-11,16-19H2,1-4H3;1H