(3-chloranyl-4-methyl-quinolin-2-yl)methyl (2S)-2-benzamidopropanoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl (2S)-2-benzamidopropanoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C21H19ClN2O3 MolecularWeight: 382.84016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)[C@H](C)NC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H19ClN2O3/c1-13-16-10-6-7-11-17(16)24-18(19(13)22)12-27-21(26)14(2)23-20(25)15-8-4-3-5-9-15/h3-11,14H,12H2,1-2H3,(H,23,25)/t14-/m0/s1