3-[3-[6,7-bis(chloranyl)-3-oxidanylidene-4H-quinoxalin-2-yl]-2-ethyl-indol-1-yl]propylazanium ethanoate

Systemtic Name: 3-[3-[6,7-bis(chloranyl)-3-oxidanylidene-4H-quinoxalin-2-yl]-2-ethyl-indol-1-yl]propylazanium ethanoate Openeye Name: 3-[3-(6,7-dichloro-3-oxo-4H-quinoxalin-2-yl)-2-ethyl-indol-1-yl]propylammonium acetate CAS Name: 3-[3-(6,7-dichloro-3-oxo-4H-quinoxalin-2-yl)-2-ethyl-1-indolyl]propylammonium acetate IUPAC Name: 3-[3-(6,7-dichloro-3-oxo-4H-quinoxalin-2-yl)-2-ethylindol-1-yl]propylazanium acetate Traditional Name: 3-[3-(6,7-dichloro-3-keto-4H-quinoxalin-2-yl)-2-ethyl-indol-1-yl]propylammonium acetate Formula: C23H24Cl2N4O3 MolecularWeight: 475.36766

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2N1CCC[NH3+])C3=NC4=CC(=C(C=C4NC3=O)Cl)Cl.CC(=O)[O-]

Isomeric SMILES

CCC1=C(C2=CC=CC=C2N1CCC[NH3+])C3=NC4=CC(=C(C=C4NC3=O)Cl)Cl.CC(=O)[O-]

InChI

InChI=1S/C21H20Cl2N4O.C2H4O2/c1-2-17-19(12-6-3-4-7-18(12)27(17)9-5-8-24)20-21(28)26-16-11-14(23)13(22)10-15(16)25-20;1-2(3)4/h3-4,6-7,10-11H,2,5,8-9,24H2,1H3,(H,26,28);1H3,(H,3,4)