2-azaniumyl-3-(1H-indol-3-yl)-2-methyl-propanoate

Systemtic Name: 2-azaniumyl-3-(1H-indol-3-yl)-2-methyl-propanoate Openeye Name: 2-azaniumyl-3-(1H-indol-3-yl)-2-methyl-propanoate CAS Name: 2-ammonio-3-(1H-indol-3-yl)-2-methylpropanoate IUPAC Name: 2-azaniumyl-3-(1H-indol-3-yl)-2-methylpropanoate Traditional Name: 2-ammonio-3-(1H-indol-3-yl)-2-methyl-propionate Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)[O-])[NH3+]

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)[O-])[NH3+]

InChI

InChI=1S/C12H14N2O2/c1-12(13,11(15)16)6-8-7-14-10-5-3-2-4-9(8)10/h2-5,7,14H,6,13H2,1H3,(H,15,16)