1,2-bis[3-(diethylamino)propyl]fluoranthene-3,9-dicarboxylate dihydrochloride

Systemtic Name: 1,2-bis[3-(diethylamino)propyl]fluoranthene-3,9-dicarboxylate dihydrochloride Openeye Name: 1,2-bis[3-(diethylamino)propyl]fluoranthene-3,9-dicarboxylate dihydrochloride CAS Name: 1,2-bis[3-(diethylamino)propyl]fluoranthene-3,9-dicarboxylate dihydrochloride IUPAC Name: 1,2-bis[3-(diethylamino)propyl]fluoranthene-3,9-dicarboxylate dihydrochloride Traditional Name: 1,2-bis[3-(diethylamino)propyl]fluoranthene-3,9-dicarboxylate dihydrochloride Formula: C32H40Cl2N2O4-2 MolecularWeight: 587.577

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC1=C2C3=C(C=CC(=C3)C(=O)[O-])C4=CC=CC(=C42)C(=C1CCCN(CC)CC)C(=O)[O-].Cl.Cl

Isomeric SMILES

CCN(CC)CCCC1=C2C3=C(C=CC(=C3)C(=O)[O-])C4=CC=CC(=C42)C(=C1CCCN(CC)CC)C(=O)[O-].Cl.Cl

InChI

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