methyl 1-[(2-oxidanylnaphthalen-1-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[(2-oxidanylnaphthalen-1-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[(2-hydroxy-1-naphthyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(2-hydroxy-1-naphthalenyl)methyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[(2-hydroxynaphthalen-1-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(2-hydroxy-1-naphthyl)methyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C18H22NO3+ MolecularWeight: 300.37218

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC[NH+](CC1)CC2=C(C=CC3=CC=CC=C32)O

Isomeric SMILES

COC(=O)C1CC[NH+](CC1)CC2=C(C=CC3=CC=CC=C32)O

InChI

InChI=1S/C18H21NO3/c1-22-18(21)14-8-10-19(11-9-14)12-16-15-5-3-2-4-13(15)6-7-17(16)20/h2-7,14,20H,8-12H2,1H3/p+1