N-methyl-N-[4-[(7-methyl-3H-imidazo[4,5-f]quinolin-9-yl)amino]phenyl]ethanamide hydrate hydrochloride

Systemtic Name: N-methyl-N-[4-[(7-methyl-3H-imidazo[4,5-f]quinolin-9-yl)amino]phenyl]ethanamide hydrate hydrochloride Openeye Name: N-methyl-N-[4-[(7-methyl-3H-imidazo[4,5-f]quinolin-9-yl)amino]phenyl]acetamide hydrate hydrochloride CAS Name: N-methyl-N-[4-[(7-methyl-3H-imidazo[4,5-f]quinolin-9-yl)amino]phenyl]acetamide hydrate hydrochloride IUPAC Name: N-methyl-N-[4-[(7-methyl-3H-imidazo[4,5-f]quinolin-9-yl)amino]phenyl]acetamide hydrate hydrochloride Traditional Name: N-methyl-N-[4-[(7-methyl-3H-imidazo[4,5-f]quinolin-9-yl)amino]phenyl]acetamide hydrate hydrochloride Formula: C20H22ClN5O2 MolecularWeight: 399.87398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N5O.ClH.H2O/c1-12-10-18(19-16(23-12)8-9-17-20(19)22-11-21-17)24-14-4-6-15(7-5-14)25(3)13(2)26;;/h4-11H,1-3H3,(H,21,22)(H,23,24);1H;1H2