methyl (2R)-2-(6-methylnaphthalen-2-yl)-2-[(2S)-pyrrolidin-1-ium-2-yl]ethanoate chloride

Systemtic Name: methyl (2R)-2-(6-methylnaphthalen-2-yl)-2-[(2S)-pyrrolidin-1-ium-2-yl]ethanoate chloride Openeye Name: methyl (2R)-2-(6-methyl-2-naphthyl)-2-[(2S)-pyrrolidin-1-ium-2-yl]acetate chloride CAS Name: (2R)-2-(6-methyl-2-naphthalenyl)-2-[(2S)-2-pyrrolidin-1-iumyl]acetic acid methyl ester chloride IUPAC Name: methyl (2R)-2-(6-methylnaphthalen-2-yl)-2-[(2S)-pyrrolidin-1-ium-2-yl]acetate chloride Traditional Name: (2R)-2-(6-methyl-2-naphthyl)-2-[(2S)-pyrrolidin-1-ium-2-yl]acetic acid methyl ester chloride Formula: C18H22ClNO2 MolecularWeight: 319.82578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C=C2)C(C3CCC[NH2+]3)C(=O)OC.[Cl-]

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C=C2)[C@H]([C@@H]3CCC[NH2+]3)C(=O)OC.[Cl-]

InChI

InChI=1S/C18H21NO2.ClH/c1-12-5-6-14-11-15(8-7-13(14)10-12)17(18(20)21-2)16-4-3-9-19-16;/h5-8,10-11,16-17,19H,3-4,9H2,1-2H3;1H/t16-,17+;/m0./s1