(3-chloranyl-4-methyl-quinolin-2-yl)methyl 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-benzoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-benzoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl 4-(2-amino-2-oxo-ethoxy)-3-methoxy-benzoate CAS Name: 4-(2-amino-2-oxoethoxy)-3-methoxybenzoic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl 4-(2-amino-2-oxoethoxy)-3-methoxybenzoate Traditional Name: 4-(2-amino-2-keto-ethoxy)-3-methoxy-benzoic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C21H19ClN2O5 MolecularWeight: 414.83896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O5/c1-12-14-5-3-4-6-15(14)24-16(20(12)22)10-29-21(26)13-7-8-17(18(9-13)27-2)28-11-19(23)25/h3-9H,10-11H2,1-2H3,(H2,23,25)