2-[5-bromanyl-2-(ethylamino)phenyl]-4-ethyl-2H-benzo[g]quinoxalin-4-ium-3-one

Systemtic Name: 2-[5-bromanyl-2-(ethylamino)phenyl]-4-ethyl-2H-benzo[g]quinoxalin-4-ium-3-one Openeye Name: 2-[5-bromo-2-(ethylamino)phenyl]-4-ethyl-2H-benzo[g]quinoxalin-4-ium-3-one CAS Name: 2-[5-bromo-2-(ethylamino)phenyl]-4-ethyl-2H-benzo[g]quinoxalin-4-ium-3-one IUPAC Name: 2-[5-bromo-2-(ethylamino)phenyl]-4-ethyl-2H-benzo[g]quinoxalin-4-ium-3-one Traditional Name: 2-[5-bromo-2-(ethylamino)phenyl]-4-ethyl-2H-benzo[g]quinoxalin-4-ium-3-one Formula: C22H21BrN3O+ MolecularWeight: 423.32564

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)Br)C2C(=O)[N+](=C3C=C4C=CC=CC4=CC3=N2)CC

Isomeric SMILES

CCNC1=C(C=C(C=C1)Br)C2C(=O)[N+](=C3C=C4C=CC=CC4=CC3=N2)CC

InChI

InChI=1S/C22H21BrN3O/c1-3-24-18-10-9-16(23)13-17(18)21-22(27)26(4-2)20-12-15-8-6-5-7-14(15)11-19(20)25-21/h5-13,21,24H,3-4H2,1-2H3/q+1