(1-methylquinolin-1-ium-7-yl) (2S)-2-phenylpropanoate hydroxide

Systemtic Name: (1-methylquinolin-1-ium-7-yl) (2S)-2-phenylpropanoate hydroxide Openeye Name: (1-methylquinolin-1-ium-7-yl) (2S)-2-phenylpropanoate hydroxide CAS Name: (2S)-2-phenylpropanoic acid (1-methyl-7-quinolin-1-iumyl) ester hydroxide IUPAC Name: (1-methylquinolin-1-ium-7-yl) (2S)-2-phenylpropanoate hydroxide Traditional Name: (2S)-2-phenylpropionic acid (1-methylquinolin-1-ium-7-yl) ester hydroxide Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(=O)OC2=CC3=C(C=CC=[N+]3C)C=C2.[OH-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)C(=O)OC2=CC3=C(C=CC=[N+]3C)C=C2.[OH-]

InChI

InChI=1S/C19H18NO2.H2O/c1-14(15-7-4-3-5-8-15)19(21)22-17-11-10-16-9-6-12-20(2)18(16)13-17;/h3-14H,1-2H3;1H2/q+1;/p-1/t14-;/m0./s1