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

Systemtic Name: 9-methyl-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium Openeye Name: 9-methyl-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium CAS Name: 9-methyl-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium IUPAC Name: 9-methyl-1,2,3,4,5,10-hexahydroazepino[3,4-b]indol-2-ium Traditional Name: 9-methyl-1,2,3,4,5,10-hexahydroazepin[3,4-b]indol-2-ium Formula: C13H17N2+ MolecularWeight: 201.28748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC3=C2CCC[NH2+]C3

Isomeric SMILES

CC1=CC=CC2=C1NC3=C2CCC[NH2+]C3

InChI

InChI=1S/C13H16N2/c1-9-4-2-5-11-10-6-3-7-14-8-12(10)15-13(9)11/h2,4-5,14-15H,3,6-8H2,1H3/p+1