N1-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-quinolin-8-yl]pentane-1,4-diamine phosphate

Systemtic Name: N1-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-quinolin-8-yl]pentane-1,4-diamine phosphate Openeye Name: N1-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-8-quinolyl]pentane-1,4-diamine phosphate CAS Name: N1-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-8-quinolinyl]pentane-1,4-diamine phosphate IUPAC Name: 1-N-[6-methoxy-5-(4-methoxyphenoxy)-4-methylquinolin-8-yl]pentane-1,4-diamine phosphate Traditional Name: 4-aminopentyl-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-8-quinolyl]amine phosphate Formula: C23H29N3O7P-3 MolecularWeight: 490.466021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C(C2=NC=C1)NCCCC(C)N)OC)OC3=CC=C(C=C3)OC.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CC1=C2C(=C(C=C(C2=NC=C1)NCCCC(C)N)OC)OC3=CC=C(C=C3)OC.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C23H29N3O3.H3O4P/c1-15-11-13-26-22-19(25-12-5-6-16(2)24)14-20(28-4)23(21(15)22)29-18-9-7-17(27-3)8-10-18;1-5(2,3)4/h7-11,13-14,16,25H,5-6,12,24H2,1-4H3;(H3,1,2,3,4)/p-3