methyl (2R,4S)-4-oxidanyl-1-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl (2R,4S)-4-oxidanyl-1-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl (2R,4S)-4-hydroxy-1-[(2R)-tetralin-2-yl]pyrrolidin-1-ium-2-carboxylate CAS Name: (2R,4S)-4-hydroxy-1-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-4-hydroxy-1-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2R,4S)-4-hydroxy-1-[(2R)-tetralin-2-yl]pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C16H22NO3+ MolecularWeight: 276.35078

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(C[NH+]1C2CCC3=CC=CC=C3C2)O

Isomeric SMILES

COC(=O)[C@H]1C[C@@H](C[NH+]1[C@@H]2CCC3=CC=CC=C3C2)O

InChI

InChI=1S/C16H21NO3/c1-20-16(19)15-9-14(18)10-17(15)13-7-6-11-4-2-3-5-12(11)8-13/h2-5,13-15,18H,6-10H2,1H3/p+1/t13-,14+,15-/m1/s1