methyl 4-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]-3-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: methyl 4-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]-3-oxidanyl-naphthalene-2-carboxylate Openeye Name: methyl 3-hydroxy-4-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]naphthalene-2-carboxylate CAS Name: 3-hydroxy-4-[[(2S)-2-methyl-4-morpholin-4-iumyl]methyl]-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 3-hydroxy-4-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]naphthalene-2-carboxylate Traditional Name: 3-hydroxy-4-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]naphthalene-2-carboxylic acid methyl ester Formula: C18H22NO4+ MolecularWeight: 316.37158

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CCO1)CC2=C(C(=CC3=CC=CC=C32)C(=O)OC)O

Isomeric SMILES

C[C@H]1C[NH+](CCO1)CC2=C(C(=CC3=CC=CC=C32)C(=O)OC)O

InChI

InChI=1S/C18H21NO4/c1-12-10-19(7-8-23-12)11-16-14-6-4-3-5-13(14)9-15(17(16)20)18(21)22-2/h3-6,9,12,20H,7-8,10-11H2,1-2H3/p+1/t12-/m0/s1