2-(5-azanyl-6-chloranyl-1-ethyl-2-oxidanylidene-3H-indol-1-ium-1-yl)ethanoate

Systemtic Name: 2-(5-azanyl-6-chloranyl-1-ethyl-2-oxidanylidene-3H-indol-1-ium-1-yl)ethanoate Openeye Name: 2-(5-amino-6-chloro-1-ethyl-2-oxo-indolin-1-ium-1-yl)acetate CAS Name: 2-(5-amino-6-chloro-1-ethyl-2-oxo-3H-indol-1-ium-1-yl)acetate IUPAC Name: 2-(5-amino-6-chloro-1-ethyl-2-oxo-3H-indol-1-ium-1-yl)acetate Traditional Name: 2-(5-amino-6-chloro-1-ethyl-2-keto-indolin-1-ium-1-yl)acetate Formula: C12H13ClN2O3 MolecularWeight: 268.69622

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=O)CC2=CC(=C(C=C21)Cl)N)CC(=O)[O-]

Isomeric SMILES

CC[N+]1(C(=O)CC2=CC(=C(C=C21)Cl)N)CC(=O)[O-]

InChI

InChI=1S/C12H13ClN2O3/c1-2-15(6-12(17)18)10-5-8(13)9(14)3-7(10)4-11(15)16/h3,5H,2,4,6,14H2,1H3