methyl (3R)-1,1-dimethyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium-3-carboxylate

Systemtic Name: methyl (3R)-1,1-dimethyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium-3-carboxylate Openeye Name: methyl (3R)-1,1-dimethyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium-3-carboxylate CAS Name: (3R)-1,1-dimethyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-1,1-dimethyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-2-ium-3-carboxylate Traditional Name: (3R)-1,1-dimethyl-2,3,4,9-tetrahydro-$b-carbolin-2-ium-3-carboxylic acid methyl ester Formula: C15H19N2O2+ MolecularWeight: 259.32356

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(CC([NH2+]1)C(=O)OC)C3=CC=CC=C3N2)C

Isomeric SMILES

CC1(C2=C(C[C@@H]([NH2+]1)C(=O)OC)C3=CC=CC=C3N2)C

InChI

InChI=1S/C15H18N2O2/c1-15(2)13-10(8-12(17-15)14(18)19-3)9-6-4-5-7-11(9)16-13/h4-7,12,16-17H,8H2,1-3H3/p+1/t12-/m1/s1