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

Systemtic Name: 1-[4-[[4-(3-chloranylpropoxy)-2-methyl-phenyl]amino]-8-methoxy-quinolin-3-yl]butan-1-one Openeye Name: 1-[4-[4-(3-chloropropoxy)-2-methyl-anilino]-8-methoxy-3-quinolyl]butan-1-one CAS Name: 1-[4-[4-(3-chloropropoxy)-2-methylanilino]-8-methoxy-3-quinolinyl]-1-butanone IUPAC Name: 1-[4-[4-(3-chloropropoxy)-2-methylanilino]-8-methoxyquinolin-3-yl]butan-1-one Traditional Name: 1-[4-[4-(3-chloropropoxy)-2-methyl-anilino]-8-methoxy-3-quinolyl]butan-1-one Formula: C24H27ClN2O3 MolecularWeight: 426.93578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClN2O3/c1-4-7-21(28)19-15-26-24-18(8-5-9-22(24)29-3)23(19)27-20-11-10-17(14-16(20)2)30-13-6-12-25/h5,8-11,14-15H,4,6-7,12-13H2,1-3H3,(H,26,27)