7-methoxy-1-methyl-2-propyl-9H-pyrido[3,4-b]indol-2-ium iodide

Systemtic Name: 7-methoxy-1-methyl-2-propyl-9H-pyrido[3,4-b]indol-2-ium iodide Openeye Name: 7-methoxy-1-methyl-2-propyl-9H-pyrido[3,4-b]indol-2-ium iodide CAS Name: 7-methoxy-1-methyl-2-propyl-9H-pyrido[3,4-b]indol-2-ium iodide IUPAC Name: 7-methoxy-1-methyl-2-propyl-9H-pyrido[3,4-b]indol-2-ium iodide Traditional Name: 7-methoxy-1-methyl-2-propyl-9H-$b-carbolin-2-ium iodide Formula: C16H19IN2O MolecularWeight: 382.23933

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(C2=C(C=C1)C3=C(N2)C=C(C=C3)OC)C.[I-]

Isomeric SMILES

CCC[N+]1=C(C2=C(C=C1)C3=C(N2)C=C(C=C3)OC)C.[I-]

InChI

InChI=1S/C16H18N2O.HI/c1-4-8-18-9-7-14-13-6-5-12(19-3)10-15(13)17-16(14)11(18)2;/h5-7,9-10H,4,8H2,1-3H3;1H