1-[8-azanyl-4-[(2,6-dimethylphenyl)amino]quinolin-3-yl]butan-1-one

Systemtic Name: 1-[8-azanyl-4-[(2,6-dimethylphenyl)amino]quinolin-3-yl]butan-1-one Openeye Name: 1-[8-amino-4-(2,6-dimethylanilino)-3-quinolyl]butan-1-one CAS Name: 1-[8-amino-4-(2,6-dimethylanilino)-3-quinolinyl]-1-butanone IUPAC Name: 1-[8-amino-4-(2,6-dimethylanilino)quinolin-3-yl]butan-1-one Traditional Name: 1-[8-amino-4-(2,6-dimethylanilino)-3-quinolyl]butan-1-one Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=C(C=CC=C3C)C)C=CC=C2N

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=C(C=CC=C3C)C)C=CC=C2N

InChI

InChI=1S/C21H23N3O/c1-4-7-18(25)16-12-23-21-15(10-6-11-17(21)22)20(16)24-19-13(2)8-5-9-14(19)3/h5-6,8-12H,4,7,22H2,1-3H3,(H,23,24)