6-(phenylmethyl)-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride

Systemtic Name: 6-(phenylmethyl)-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride Openeye Name: 6-benzyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride CAS Name: 6-(phenylmethyl)-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride IUPAC Name: 6-benzyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride Traditional Name: 6-benzyl-1,2,3,4,5,6-hexahydroazepin[4,5-b]indol-6-ium chloride Formula: C19H21ClN2 MolecularWeight: 312.83644

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC2=C1C3=CC=CC=C3[NH+]2CC4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1CNCCC2=C1C3=CC=CC=C3[NH+]2CC4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C19H20N2.ClH/c1-2-6-15(7-3-1)14-21-18-9-5-4-8-16(18)17-10-12-20-13-11-19(17)21;/h1-9,20H,10-14H2;1H