N-(2-ethoxy-5-methoxy-phenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride

Systemtic Name: N-(2-ethoxy-5-methoxy-phenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride Openeye Name: N-(2-ethoxy-5-methoxy-phenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride CAS Name: N-(2-ethoxy-5-methoxyphenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride IUPAC Name: N-(2-ethoxy-5-methoxyphenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride Traditional Name: (2-ethoxy-5-methoxy-phenyl)-(7-methyl-3H-imidazo[4,5-f]quinolin-9-yl)amine hydrate hydrochloride Formula: C20H23ClN4O3 MolecularWeight: 402.87462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)OC)NC2=CC(=NC3=C2C4=C(C=C3)NC=N4)C.O.Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)OC)NC2=CC(=NC3=C2C4=C(C=C3)NC=N4)C.O.Cl

InChI

InChI=1S/C20H20N4O2.ClH.H2O/c1-4-26-18-8-5-13(25-3)10-16(18)24-17-9-12(2)23-14-6-7-15-20(19(14)17)22-11-21-15;;/h5-11H,4H2,1-3H3,(H,21,22)(H,23,24);1H;1H2