2-(pyridin-3-ylmethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium

Systemtic Name: 2-(pyridin-3-ylmethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium Openeye Name: 2-(3-pyridylmethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium CAS Name: 2-(3-pyridinylmethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium IUPAC Name: 2-(pyridin-3-ylmethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium Traditional Name: 2-(3-pyridylmethyl)-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium Formula: C17H18N3+ MolecularWeight: 264.34492

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1C3=CC=CC=C3N2)CC4=CN=CC=C4

Isomeric SMILES

C1C[NH+](CC2=C1C3=CC=CC=C3N2)CC4=CN=CC=C4

InChI

InChI=1S/C17H17N3/c1-2-6-16-14(5-1)15-7-9-20(12-17(15)19-16)11-13-4-3-8-18-10-13/h1-6,8,10,19H,7,9,11-12H2/p+1