1-[4-[(4,6-dimethyl-1,3-benzodioxol-5-yl)amino]-8-methoxy-quinolin-3-yl]butan-1-one

Systemtic Name: 1-[4-[(4,6-dimethyl-1,3-benzodioxol-5-yl)amino]-8-methoxy-quinolin-3-yl]butan-1-one Openeye Name: 1-[4-[(4,6-dimethyl-1,3-benzodioxol-5-yl)amino]-8-methoxy-3-quinolyl]butan-1-one CAS Name: 1-[4-[(4,6-dimethyl-1,3-benzodioxol-5-yl)amino]-8-methoxy-3-quinolinyl]-1-butanone IUPAC Name: 1-[4-[(4,6-dimethyl-1,3-benzodioxol-5-yl)amino]-8-methoxyquinolin-3-yl]butan-1-one Traditional Name: 1-[4-[(4,6-dimethyl-1,3-benzodioxol-5-yl)amino]-8-methoxy-3-quinolyl]butan-1-one Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=C(C4=C(C=C3C)OCO4)C)C=CC=C2OC

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=C(C4=C(C=C3C)OCO4)C)C=CC=C2OC

InChI

InChI=1S/C23H24N2O4/c1-5-7-17(26)16-11-24-22-15(8-6-9-18(22)27-4)21(16)25-20-13(2)10-19-23(14(20)3)29-12-28-19/h6,8-11H,5,7,12H2,1-4H3,(H,24,25)