butyl 4-[(2-methylquinolin-4-yl)amino]benzoate chloride

Systemtic Name: butyl 4-[(2-methylquinolin-4-yl)amino]benzoate chloride Openeye Name: butyl 4-[(2-methyl-4-quinolyl)amino]benzoate chloride CAS Name: 4-[(2-methyl-4-quinolinyl)amino]benzoic acid butyl ester chloride IUPAC Name: butyl 4-[(2-methylquinolin-4-yl)amino]benzoate chloride Traditional Name: 4-[(2-methyl-4-quinolyl)amino]benzoic acid butyl ester chloride Formula: C21H22ClN2O2- MolecularWeight: 369.86458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC2=CC(=NC3=CC=CC=C32)C.[Cl-]

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC2=CC(=NC3=CC=CC=C32)C.[Cl-]

InChI

InChI=1S/C21H22N2O2.ClH/c1-3-4-13-25-21(24)16-9-11-17(12-10-16)23-20-14-15(2)22-19-8-6-5-7-18(19)20;/h5-12,14H,3-4,13H2,1-2H3,(H,22,23);1H/p-1