methyl (1R)-1-methylspiro[2,4-dihydroisoquinolin-2-ium-3,1'-cyclohexane]-1-carboxylate

Systemtic Name: methyl (1R)-1-methylspiro[2,4-dihydroisoquinolin-2-ium-3,1'-cyclohexane]-1-carboxylate Openeye Name: methyl (1R)-1-methylspiro[2,4-dihydroisoquinolin-2-ium-3,1'-cyclohexane]-1-carboxylate CAS Name: (1R)-1-methyl-1-spiro[2,4-dihydroisoquinolin-2-ium-3,1'-cyclohexane]carboxylic acid methyl ester IUPAC Name: methyl (1R)-1-methylspiro[2,4-dihydroisoquinolin-2-ium-3,1'-cyclohexane]-1-carboxylate Traditional Name: (1R)-1-methylspiro[2,4-dihydroisoquinolin-2-ium-3,1'-cyclohexane]-1-carboxylic acid methyl ester Formula: C17H24NO2+ MolecularWeight: 274.37796

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2CC3([NH2+]1)CCCCC3)C(=O)OC

Isomeric SMILES

C[C@@]1(C2=CC=CC=C2CC3([NH2+]1)CCCCC3)C(=O)OC

InChI

InChI=1S/C17H23NO2/c1-16(15(19)20-2)14-9-5-4-8-13(14)12-17(18-16)10-6-3-7-11-17/h4-5,8-9,18H,3,6-7,10-12H2,1-2H3/p+1/t16-/m1/s1