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

Systemtic Name: (1R,3R)-1-naphthalen-1-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-3-carboxylate Openeye Name: (1R,3R)-1-(1-naphthyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-3-carboxylate CAS Name: (1R,3R)-1-(1-naphthalenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-3-carboxylate IUPAC Name: (1R,3R)-1-naphthalen-1-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-3-carboxylate Traditional Name: (1R,3R)-1-(1-naphthyl)-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium-3-carboxylate Formula: C22H18N2O2 MolecularWeight: 342.39052

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Descriptors Computed from Structure

Canonical SMILES:

C1C([NH2+]C(C2=C1C3=CC=CC=C3N2)C4=CC=CC5=CC=CC=C54)C(=O)[O-]

Isomeric SMILES

C1[C@@H]([NH2+][C@@H](C2=C1C3=CC=CC=C3N2)C4=CC=CC5=CC=CC=C54)C(=O)[O-]

InChI

InChI=1S/C22H18N2O2/c25-22(26)19-12-17-15-9-3-4-11-18(15)23-21(17)20(24-19)16-10-5-7-13-6-1-2-8-14(13)16/h1-11,19-20,23-24H,12H2,(H,25,26)/t19-,20-/m1/s1