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

Systemtic Name: methyl 4-[2-(4-azanylimidazo[4,5-c]quinolin-1-yl)propoxymethyl]benzoate Openeye Name: methyl 4-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)propoxymethyl]benzoate CAS Name: 4-[2-(4-amino-1-imidazo[4,5-c]quinolinyl)propoxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)propoxymethyl]benzoate Traditional Name: 4-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)propoxymethyl]benzoic acid methyl ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CC=C(C=C1)C(=O)OC)N2C=NC3=C2C4=CC=CC=C4N=C3N

Isomeric SMILES

CC(COCC1=CC=C(C=C1)C(=O)OC)N2C=NC3=C2C4=CC=CC=C4N=C3N

InChI

InChI=1S/C22H22N4O3/c1-14(11-29-12-15-7-9-16(10-8-15)22(27)28-2)26-13-24-19-20(26)17-5-3-4-6-18(17)25-21(19)23/h3-10,13-14H,11-12H2,1-2H3,(H2,23,25)