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

Systemtic Name: 1-[8-(4-azanyl-2-methyl-butan-2-yl)oxy-4-[(2-methylphenyl)amino]quinolin-3-yl]butan-1-one Openeye Name: 1-[8-(3-amino-1,1-dimethyl-propoxy)-4-(2-methylanilino)-3-quinolyl]butan-1-one CAS Name: 1-[8-(4-amino-2-methylbutan-2-yl)oxy-4-(2-methylanilino)-3-quinolinyl]-1-butanone IUPAC Name: 1-[8-(4-amino-2-methylbutan-2-yl)oxy-4-(2-methylanilino)quinolin-3-yl]butan-1-one Traditional Name: 1-[8-(3-amino-1,1-dimethyl-propoxy)-4-(o-toluidino)-3-quinolyl]butan-1-one Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C)C=CC=C2OC(C)(C)CCN

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C)C=CC=C2OC(C)(C)CCN

InChI

InChI=1S/C25H31N3O2/c1-5-9-21(29)19-16-27-24-18(23(19)28-20-12-7-6-10-17(20)2)11-8-13-22(24)30-25(3,4)14-15-26/h6-8,10-13,16H,5,9,14-15,26H2,1-4H3,(H,27,28)