7-chloranyl-N-[4-methoxy-3-[(2-methylpropylamino)methyl]phenyl]quinolin-4-amine hydrochloride

Systemtic Name: 7-chloranyl-N-[4-methoxy-3-[(2-methylpropylamino)methyl]phenyl]quinolin-4-amine hydrochloride Openeye Name: 7-chloro-N-[3-[(isobutylamino)methyl]-4-methoxy-phenyl]quinolin-4-amine hydrochloride CAS Name: 7-chloro-N-[4-methoxy-3-[(2-methylpropylamino)methyl]phenyl]-4-quinolinamine hydrochloride IUPAC Name: 7-chloro-N-[4-methoxy-3-[(2-methylpropylamino)methyl]phenyl]quinolin-4-amine hydrochloride Traditional Name: (7-chloro-4-quinolyl)-[3-[(isobutylamino)methyl]-4-methoxy-phenyl]amine hydrochloride Formula: C21H25Cl2N3O MolecularWeight: 406.3487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)OC.Cl

Isomeric SMILES

CC(C)CNCC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)OC.Cl

InChI

InChI=1S/C21H24ClN3O.ClH/c1-14(2)12-23-13-15-10-17(5-7-21(15)26-3)25-19-8-9-24-20-11-16(22)4-6-18(19)20;/h4-11,14,23H,12-13H2,1-3H3,(H,24,25);1H