(3-chloranyl-4-methyl-quinolin-2-yl)methyl 3,4,5-trimethoxybenzoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl 3,4,5-trimethoxybenzoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C21H20ClNO5 MolecularWeight: 401.8402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC(=C(C(=C3)OC)OC)OC)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC(=C(C(=C3)OC)OC)OC)Cl

InChI

InChI=1S/C21H20ClNO5/c1-12-14-7-5-6-8-15(14)23-16(19(12)22)11-28-21(24)13-9-17(25-2)20(27-4)18(10-13)26-3/h5-10H,11H2,1-4H3