methyl 4-azanyl-1-(phenylmethyl)-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylate

Systemtic Name: methyl 4-azanyl-1-(phenylmethyl)-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylate Openeye Name: methyl 4-amino-1-benzyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylate CAS Name: 4-amino-1-(phenylmethyl)-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylic acid methyl ester IUPAC Name: methyl 4-amino-1-benzyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylate Traditional Name: 4-amino-1-benzyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylic acid methyl ester Formula: C14H19N2O2+ MolecularWeight: 247.31286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CC[NH+](C1)CC2=CC=CC=C2)N

Isomeric SMILES

COC(=O)C1=C(CC[NH+](C1)CC2=CC=CC=C2)N

InChI

InChI=1S/C14H18N2O2/c1-18-14(17)12-10-16(8-7-13(12)15)9-11-5-3-2-4-6-11/h2-6H,7-10,15H2,1H3/p+1