7,9-dimethoxy-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium

Systemtic Name: 7,9-dimethoxy-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium Openeye Name: 7,9-dimethoxy-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium CAS Name: 7,9-dimethoxy-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium IUPAC Name: 7,9-dimethoxy-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium Traditional Name: 7,9-dimethoxy-1,2,3,4,5,10-hexahydroazepin[3,4-b]indol-2-ium Formula: C14H19N2O2+ MolecularWeight: 247.31286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C3=C(N2)C[NH2+]CCC3)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)C3=C(N2)C[NH2+]CCC3)OC

InChI

InChI=1S/C14H18N2O2/c1-17-9-6-11-10-4-3-5-15-8-12(10)16-14(11)13(7-9)18-2/h6-7,15-16H,3-5,8H2,1-2H3/p+1