methyl 4-[2-(4-azanylimidazo[4,5-c]quinolin-1-yl)ethoxymethyl]benzoate

Systemtic Name: methyl 4-[2-(4-azanylimidazo[4,5-c]quinolin-1-yl)ethoxymethyl]benzoate Openeye Name: methyl 4-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)ethoxymethyl]benzoate CAS Name: 4-[2-(4-amino-1-imidazo[4,5-c]quinolinyl)ethoxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)ethoxymethyl]benzoate Traditional Name: 4-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)ethoxymethyl]benzoic acid methyl ester Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COCCN2C=NC3=C2C4=CC=CC=C4N=C3N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COCCN2C=NC3=C2C4=CC=CC=C4N=C3N

InChI

InChI=1S/C21H20N4O3/c1-27-21(26)15-8-6-14(7-9-15)12-28-11-10-25-13-23-18-19(25)16-4-2-3-5-17(16)24-20(18)22/h2-9,13H,10-12H2,1H3,(H2,22,24)