2-(2-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-2-ium-8-yl)ethanoate

Systemtic Name: 2-(2-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-2-ium-8-yl)ethanoate Openeye Name: 2-(2-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-2-ium-8-yl)acetate CAS Name: 2-(2-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-2-ium-8-yl)acetate IUPAC Name: 2-(2-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-2-ium-8-yl)acetate Traditional Name: 2-(2-methyl-2,3,4,5-tetrahydro-1H-pyrid[4,3-b]indol-2-ium-8-yl)acetate Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C1)C3=C(N2)C=CC(=C3)CC(=O)[O-]

Isomeric SMILES

C[NH+]1CCC2=C(C1)C3=C(N2)C=CC(=C3)CC(=O)[O-]

InChI

InChI=1S/C14H16N2O2/c1-16-5-4-13-11(8-16)10-6-9(7-14(17)18)2-3-12(10)15-13/h2-3,6,15H,4-5,7-8H2,1H3,(H,17,18)