1-[8-methyl-4-[(2-methylphenyl)amino]quinolin-3-yl]butan-1-one

Systemtic Name: 1-[8-methyl-4-[(2-methylphenyl)amino]quinolin-3-yl]butan-1-one Openeye Name: 1-[8-methyl-4-(2-methylanilino)-3-quinolyl]butan-1-one CAS Name: 1-[8-methyl-4-(2-methylanilino)-3-quinolinyl]-1-butanone IUPAC Name: 1-[8-methyl-4-(2-methylanilino)quinolin-3-yl]butan-1-one Traditional Name: 1-[8-methyl-4-(o-toluidino)-3-quinolyl]butan-1-one Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=CC=CC2=C1NC3=CC=CC=C3C)C

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=CC=CC2=C1NC3=CC=CC=C3C)C

InChI

InChI=1S/C21H22N2O/c1-4-8-19(24)17-13-22-20-15(3)10-7-11-16(20)21(17)23-18-12-6-5-9-14(18)2/h5-7,9-13H,4,8H2,1-3H3,(H,22,23)