(3-chloranyl-4-methyl-quinolin-2-yl)methyl 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzoxazin-4-yl)propanoic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)propionic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C22H19ClN2O4 MolecularWeight: 410.85026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCN3C(=O)COC4=CC=CC=C43)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCN3C(=O)COC4=CC=CC=C43)Cl

InChI

InChI=1S/C22H19ClN2O4/c1-14-15-6-2-3-7-16(15)24-17(22(14)23)12-29-21(27)10-11-25-18-8-4-5-9-19(18)28-13-20(25)26/h2-9H,10-13H2,1H3