2-[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]ethanoate

Systemtic Name: 2-[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]ethanoate Openeye Name: 2-[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]acetate CAS Name: 2-[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]acetate IUPAC Name: 2-[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]acetate Traditional Name: 2-[(1R)-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium-1-yl]acetate Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C(C2=C1C3=CC=CC=C3N2)CC(=O)[O-]

Isomeric SMILES

C1C[NH2+][C@@H](C2=C1C3=CC=CC=C3N2)CC(=O)[O-]

InChI

InChI=1S/C13H14N2O2/c16-12(17)7-11-13-9(5-6-14-11)8-3-1-2-4-10(8)15-13/h1-4,11,14-15H,5-7H2,(H,16,17)/t11-/m1/s1