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

Systemtic Name: 1-[8-ethenyl-4-[(2-methyl-4-oxidanyl-phenyl)amino]quinolin-3-yl]butan-1-one Openeye Name: 1-[4-(4-hydroxy-2-methyl-anilino)-8-vinyl-3-quinolyl]butan-1-one CAS Name: 1-[8-ethenyl-4-(4-hydroxy-2-methylanilino)-3-quinolinyl]-1-butanone IUPAC Name: 1-[8-ethenyl-4-(4-hydroxy-2-methylanilino)quinolin-3-yl]butan-1-one Traditional Name: 1-[4-(4-hydroxy-2-methyl-anilino)-8-vinyl-3-quinolyl]butan-1-one Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)O)C)C=CC=C2C=C

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)O)C)C=CC=C2C=C

InChI

InChI=1S/C22H22N2O2/c1-4-7-20(26)18-13-23-21-15(5-2)8-6-9-17(21)22(18)24-19-11-10-16(25)12-14(19)3/h5-6,8-13,25H,2,4,7H2,1,3H3,(H,23,24)