N-(6-methoxyquinolin-8-yl)-N'-propan-2-yl-pentane-1,5-diamine phosphate

Systemtic Name: N-(6-methoxyquinolin-8-yl)-N'-propan-2-yl-pentane-1,5-diamine phosphate Openeye Name: N'-isopropyl-N-(6-methoxy-8-quinolyl)pentane-1,5-diamine phosphate CAS Name: N-(6-methoxy-8-quinolinyl)-N'-propan-2-ylpentane-1,5-diamine phosphate IUPAC Name: N-(6-methoxyquinolin-8-yl)-N'-propan-2-ylpentane-1,5-diamine phosphate Traditional Name: isopropyl-[5-[(6-methoxy-8-quinolyl)amino]pentyl]amine phosphate Formula: C18H27N3O5P-3 MolecularWeight: 396.397841

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCCCNC1=C2C(=CC(=C1)OC)C=CC=N2.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CC(C)NCCCCCNC1=C2C(=CC(=C1)OC)C=CC=N2.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C18H27N3O.H3O4P/c1-14(2)19-9-5-4-6-10-20-17-13-16(22-3)12-15-8-7-11-21-18(15)17;1-5(2,3)4/h7-8,11-14,19-20H,4-6,9-10H2,1-3H3;(H3,1,2,3,4)/p-3