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

Systemtic Name: 1-[2-methyl-4-[(2-methylphenyl)amino]quinolin-3-yl]butan-1-one Openeye Name: 1-[2-methyl-4-(2-methylanilino)-3-quinolyl]butan-1-one CAS Name: 1-[2-methyl-4-(2-methylanilino)-3-quinolinyl]-1-butanone IUPAC Name: 1-[2-methyl-4-(2-methylanilino)quinolin-3-yl]butan-1-one Traditional Name: 1-[2-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=C(C2=CC=CC=C2N=C1C)NC3=CC=CC=C3C

Isomeric SMILES

CCCC(=O)C1=C(C2=CC=CC=C2N=C1C)NC3=CC=CC=C3C

InChI

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