methanesulfonic acid; 1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine; hydrate

Systemtic Name: methanesulfonic acid; 1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine; hydrate Openeye Name: 1-isobutylimidazo[4,5-c]quinolin-4-amine; methanesulfonic acid; hydrate CAS Name: methanesulfonic acid; 1-(2-methylpropyl)-4-imidazo[4,5-c]quinolinamine; hydrate IUPAC Name: methanesulfonic acid; 1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine; hydrate Traditional Name: (1-isobutylimidazo[4,5-c]quinolin-4-yl)amine; mesylic acid; hydrate Formula: C15H22N4O4S MolecularWeight: 354.42458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=NC2=C1C3=CC=CC=C3N=C2N.CS(=O)(=O)O.O

Isomeric SMILES

CC(C)CN1C=NC2=C1C3=CC=CC=C3N=C2N.CS(=O)(=O)O.O

InChI

InChI=1S/C14H16N4.CH4O3S.H2O/c1-9(2)7-18-8-16-12-13(18)10-5-3-4-6-11(10)17-14(12)15;1-5(2,3)4;/h3-6,8-9H,7H2,1-2H3,(H2,15,17);1H3,(H,2,3,4);1H2