1,3-bis(3-piperidin-1-ylpropyl)-9H-xanthene-2,7-dicarboxylate dihydrochloride

Systemtic Name: 1,3-bis(3-piperidin-1-ylpropyl)-9H-xanthene-2,7-dicarboxylate dihydrochloride Openeye Name: 1,3-bis[3-(1-piperidyl)propyl]-9H-xanthene-2,7-dicarboxylate dihydrochloride CAS Name: 1,3-bis[3-(1-piperidinyl)propyl]-9H-xanthene-2,7-dicarboxylate dihydrochloride IUPAC Name: 1,3-bis(3-piperidin-1-ylpropyl)-9H-xanthene-2,7-dicarboxylate dihydrochloride Traditional Name: 1,3-bis(3-piperidinopropyl)-9H-xanthene-2,7-dicarboxylate dihydrochloride Formula: C31H40Cl2N2O5-2 MolecularWeight: 591.5657

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCC2=CC3=C(CC4=C(O3)C=CC(=C4)C(=O)[O-])C(=C2C(=O)[O-])CCCN5CCCCC5.Cl.Cl

Isomeric SMILES

C1CCN(CC1)CCCC2=CC3=C(CC4=C(O3)C=CC(=C4)C(=O)[O-])C(=C2C(=O)[O-])CCCN5CCCCC5.Cl.Cl

InChI

InChI=1S/C31H40N2O5.2ClH/c34-30(35)23-11-12-27-24(19-23)20-26-25(10-8-18-33-15-5-2-6-16-33)29(31(36)37)22(21-28(26)38-27)9-7-17-32-13-3-1-4-14-32;;/h11-12,19,21H,1-10,13-18,20H2,(H,34,35)(H,36,37);2*1H/p-2