2-[3-[(3,4-dichlorophenyl)methylamino]propylamino]-6-methyl-1H-quinolin-4-one dihydrochloride

Systemtic Name: 2-[3-[(3,4-dichlorophenyl)methylamino]propylamino]-6-methyl-1H-quinolin-4-one dihydrochloride Openeye Name: 2-[3-[(3,4-dichlorophenyl)methylamino]propylamino]-6-methyl-1H-quinolin-4-one dihydrochloride CAS Name: 2-[3-[(3,4-dichlorophenyl)methylamino]propylamino]-6-methyl-1H-quinolin-4-one dihydrochloride IUPAC Name: 2-[3-[(3,4-dichlorophenyl)methylamino]propylamino]-6-methyl-1H-quinolin-4-one dihydrochloride Traditional Name: 2-[3-[(3,4-dichlorobenzyl)amino]propylamino]-6-methyl-4-quinolone dihydrochloride Formula: C20H23Cl4N3O MolecularWeight: 463.22812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=CC2=O)NCCCNCC3=CC(=C(C=C3)Cl)Cl.Cl.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=CC2=O)NCCCNCC3=CC(=C(C=C3)Cl)Cl.Cl.Cl

InChI

InChI=1S/C20H21Cl2N3O.2ClH/c1-13-3-6-18-15(9-13)19(26)11-20(25-18)24-8-2-7-23-12-14-4-5-16(21)17(22)10-14;;/h3-6,9-11,23H,2,7-8,12H2,1H3,(H2,24,25,26);2*1H