hydrogen phosphate; N4-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-quinolin-8-yl]pentane-1,4-diamine

Systemtic Name: hydrogen phosphate; N4-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-quinolin-8-yl]pentane-1,4-diamine Openeye Name: hydrogen phosphate; N4-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-8-quinolyl]pentane-1,4-diamine CAS Name: hydrogen phosphate; N4-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-8-quinolinyl]pentane-1,4-diamine IUPAC Name: hydrogen phosphate; 4-N-[6-methoxy-5-(4-methoxyphenoxy)-4-methylquinolin-8-yl]pentane-1,4-diamine Traditional Name: (4-amino-1-methyl-butyl)-[6-methoxy-5-(4-methoxyphenoxy)-4-methyl-8-quinolyl]amine; hydrogen phosphate Formula: C23H30N3O7P-2 MolecularWeight: 491.473961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C(C2=NC=C1)NC(C)CCCN)OC)OC3=CC=C(C=C3)OC.OP(=O)([O-])[O-]

Isomeric SMILES

CC1=C2C(=C(C=C(C2=NC=C1)NC(C)CCCN)OC)OC3=CC=C(C=C3)OC.OP(=O)([O-])[O-]

InChI

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