8-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride

Systemtic Name: 8-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride Openeye Name: 8-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride CAS Name: 8-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride IUPAC Name: 8-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride Traditional Name: 8-methoxy-1,2,3,4,5,6-hexahydroazepin[4,5-b]indol-6-ium chloride Formula: C13H17ClN2O MolecularWeight: 252.73988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C([NH2+]2)CCNCC3.[Cl-]

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C([NH2+]2)CCNCC3.[Cl-]

InChI

InChI=1S/C13H16N2O.ClH/c1-16-9-2-3-10-11-4-6-14-7-5-12(11)15-13(10)8-9;/h2-3,8,14-15H,4-7H2,1H3;1H