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

Systemtic Name: 1-[8-[2-(dimethylamino)-1-oxidanyl-ethyl]-4-[(2-methylphenyl)amino]quinolin-3-yl]butan-1-one Openeye Name: 1-[8-[2-(dimethylamino)-1-hydroxy-ethyl]-4-(2-methylanilino)-3-quinolyl]butan-1-one CAS Name: 1-[8-[2-(dimethylamino)-1-hydroxyethyl]-4-(2-methylanilino)-3-quinolinyl]-1-butanone IUPAC Name: 1-[8-[2-(dimethylamino)-1-hydroxyethyl]-4-(2-methylanilino)quinolin-3-yl]butan-1-one Traditional Name: 1-[8-[2-(dimethylamino)-1-hydroxy-ethyl]-4-(o-toluidino)-3-quinolyl]butan-1-one Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O2/c1-5-9-21(28)19-14-25-23-17(22(29)15-27(3)4)11-8-12-18(23)24(19)26-20-13-7-6-10-16(20)2/h6-8,10-14,22,29H,5,9,15H2,1-4H3,(H,25,26)