1,9-bis(4-fluorophenyl)-2,8-bis(morpholin-4-ium-4-ylmethyl)nonane-1,9-dione

Systemtic Name: 1,9-bis(4-fluorophenyl)-2,8-bis(morpholin-4-ium-4-ylmethyl)nonane-1,9-dione Openeye Name: 1,9-bis(4-fluorophenyl)-2,8-bis(morpholin-4-ium-4-ylmethyl)nonane-1,9-dione CAS Name: 1,9-bis(4-fluorophenyl)-2,8-bis(4-morpholin-4-iumylmethyl)nonane-1,9-dione IUPAC Name: 1,9-bis(4-fluorophenyl)-2,8-bis(morpholin-4-ium-4-ylmethyl)nonane-1,9-dione Traditional Name: 1,9-bis(4-fluorophenyl)-2,8-bis(morpholin-4-ium-4-ylmethyl)nonane-1,9-dione Formula: C31H42F2N2O4+2 MolecularWeight: 544.672986

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(CCCCCC(C[NH+]2CCOCC2)C(=O)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1COCC[NH+]1CC(CCCCCC(C[NH+]2CCOCC2)C(=O)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C31H40F2N2O4/c32-28-10-6-24(7-11-28)30(36)26(22-34-14-18-38-19-15-34)4-2-1-3-5-27(23-35-16-20-39-21-17-35)31(37)25-8-12-29(33)13-9-25/h6-13,26-27H,1-5,14-23H2/p+2