2-[4-[(7-chloranylquinolin-4-yl)amino]pentyl-ethyl-amino]ethyl phosphono hydrogen phosphate

Systemtic Name: 2-[4-[(7-chloranylquinolin-4-yl)amino]pentyl-ethyl-amino]ethyl phosphono hydrogen phosphate Openeye Name: 2-[4-[(7-chloro-4-quinolyl)amino]pentyl-ethyl-amino]ethyl phosphono hydrogen phosphate CAS Name: 2-[4-[(7-chloro-4-quinolinyl)amino]pentyl-ethylamino]ethyl phosphono hydrogen phosphate IUPAC Name: 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethyl phosphono hydrogen phosphate Traditional Name: 2-[4-[(7-chloro-4-quinolyl)amino]pentyl-ethyl-amino]ethyl phosphono hydrogen phosphate Formula: C18H28ClN3O7P2 MolecularWeight: 495.831342

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCOP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCOP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C18H28ClN3O7P2/c1-3-22(11-12-28-31(26,27)29-30(23,24)25)10-4-5-14(2)21-17-8-9-20-18-13-15(19)6-7-16(17)18/h6-9,13-14H,3-5,10-12H2,1-2H3,(H,20,21)(H,26,27)(H2,23,24,25)