2-(furan-2-yl)-N-(4-methoxyphenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride

Systemtic Name: 2-(furan-2-yl)-N-(4-methoxyphenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride Openeye Name: 2-(2-furyl)-N-(4-methoxyphenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride CAS Name: 2-(2-furanyl)-N-(4-methoxyphenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride IUPAC Name: 2-(furan-2-yl)-N-(4-methoxyphenyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-amine hydrate hydrochloride Traditional Name: [2-(2-furyl)-7-methyl-3H-imidazo[4,5-f]quinolin-9-yl]-(4-methoxyphenyl)amine hydrate hydrochloride Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)NC3=CC=C(C=C3)OC)C4=C(C=C2)NC(=N4)C5=CC=CO5.O.Cl

Isomeric SMILES

CC1=NC2=C(C(=C1)NC3=CC=C(C=C3)OC)C4=C(C=C2)NC(=N4)C5=CC=CO5.O.Cl

InChI

InChI=1S/C22H18N4O2.ClH.H2O/c1-13-12-18(24-14-5-7-15(27-2)8-6-14)20-16(23-13)9-10-17-21(20)26-22(25-17)19-4-3-11-28-19;;/h3-12H,1-2H3,(H,23,24)(H,25,26);1H;1H2