1-[4-[[3-(dimethylaminomethyl)-4-oxidanyl-phenyl]amino]-8-methoxy-quinolin-3-yl]butan-1-one

Systemtic Name: 1-[4-[[3-(dimethylaminomethyl)-4-oxidanyl-phenyl]amino]-8-methoxy-quinolin-3-yl]butan-1-one Openeye Name: 1-[4-[3-(dimethylaminomethyl)-4-hydroxy-anilino]-8-methoxy-3-quinolyl]butan-1-one CAS Name: 1-[4-[3-(dimethylaminomethyl)-4-hydroxyanilino]-8-methoxy-3-quinolinyl]-1-butanone IUPAC Name: 1-[4-[3-(dimethylaminomethyl)-4-hydroxyanilino]-8-methoxyquinolin-3-yl]butan-1-one Traditional Name: 1-[4-[3-(dimethylaminomethyl)-4-hydroxy-anilino]-8-methoxy-3-quinolyl]butan-1-one Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=CC(=C(C=C3)O)CN(C)C)C=CC=C2OC

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=CC(=C(C=C3)O)CN(C)C)C=CC=C2OC

InChI

InChI=1S/C23H27N3O3/c1-5-7-20(28)18-13-24-23-17(8-6-9-21(23)29-4)22(18)25-16-10-11-19(27)15(12-16)14-26(2)3/h6,8-13,27H,5,7,14H2,1-4H3,(H,24,25)