3-[2-ethyl-3-(7-methoxy-3-oxidanylidene-4H-quinoxalin-2-yl)indol-1-yl]propylazanium ethanoate

Systemtic Name: 3-[2-ethyl-3-(7-methoxy-3-oxidanylidene-4H-quinoxalin-2-yl)indol-1-yl]propylazanium ethanoate Openeye Name: 3-[2-ethyl-3-(7-methoxy-3-oxo-4H-quinoxalin-2-yl)indol-1-yl]propylammonium acetate CAS Name: 3-[2-ethyl-3-(7-methoxy-3-oxo-4H-quinoxalin-2-yl)-1-indolyl]propylammonium acetate IUPAC Name: 3-[2-ethyl-3-(7-methoxy-3-oxo-4H-quinoxalin-2-yl)indol-1-yl]propylazanium acetate Traditional Name: 3-[2-ethyl-3-(3-keto-7-methoxy-4H-quinoxalin-2-yl)indol-1-yl]propylammonium acetate Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2N1CCC[NH3+])C3=NC4=C(C=CC(=C4)OC)NC3=O.CC(=O)[O-]

Isomeric SMILES

CCC1=C(C2=CC=CC=C2N1CCC[NH3+])C3=NC4=C(C=CC(=C4)OC)NC3=O.CC(=O)[O-]

InChI

InChI=1S/C22H24N4O2.C2H4O2/c1-3-18-20(15-7-4-5-8-19(15)26(18)12-6-11-23)21-22(27)25-16-10-9-14(28-2)13-17(16)24-21;1-2(3)4/h4-5,7-10,13H,3,6,11-12,23H2,1-2H3,(H,25,27);1H3,(H,3,4)